A0A087XPI5_POEFO Loading...

Soluble calcium-activated nucleotidase 1

AlphaFold DB , UniProt , Accession A0A087XPI5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 425 aa.

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(Predicted Aligned Error values between residue pairs)

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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	35.8	Very low	35.4	Very low	238 Å²	238	164.3 Å²	164.3	100%	1.172	88%	0.883	S	S	*	*				0	126	0	-75.6	164.5	166.8	0	0	107.5
2	T	37.3	Very low	35.3	Very low	117 Å²	117	171.7 Å²	171.7	72%	0.718	89%	0.889	S	S	*	*			cis	-157.7	159	-6.5	-53.1	0	0	0	0	108
3	Q	35.1	Very low	35.4	Very low	175 Å²	175	175.3 Å²	175.3	82%	0.818	89%	0.894	S	S	*	*			trans	0.5	157.7	160.5	-64.3	-173.5	-23.8	0	0	122.1
4	V	38.2	Very low	35	Very low	127 Å²	127	167.9 Å²	167.9	77%	0.77	88%	0.882	S	S	*	*			cis	-159.3	168.5	-6.9	126.3	0	0	0	0	110.2
5	K	37	Very low	35.1	Very low	193 Å²	193	173.7 Å²	173.7	84%	0.839	89%	0.888	S	S	*	*			trans	-70.6	143.9	-172.1	-60.1	163.4	177.2	172.9	0	115.3
6	N	34.2	Very low	35	Very low	170 Å²	170	170.8 Å²	170.8	91%	0.909	89%	0.888	S	S	*	*			trans	-73.5	146.4	154.1	-93.1	-23.6	0	0	0	111.2
7	S	36.2	Very low	34.9	Very low	124 Å²	124	174.8 Å²	174.8	87%	0.867	89%	0.888	S	S	*	*			trans	-109.2	127.2	174.1	55.2	0	0	0	0	111.1
8	G	33.3	Very low	36.3	Very low	86 Å²	86	171.4 Å²	171.4	89%	0.887	88%	0.881	S	S	*	*			trans	-143	110.5	174.4	0	0	0	0	0	109.3
9	G	33.2	Very low	37.1	Very low	85 Å²	85	167.9 Å²	167.9	88%	0.876	87%	0.87	S	S	*	*			trans	-138.5	110.8	-175.1	0	0	0	0	0	111.8
10	R	34.6	Very low	36.9	Very low	248 Å²	248	164.5 Å²	164.5	94%	0.936	86%	0.861	S	S	*	*			trans	-137.6	137.3	175	-141	179.6	-169	-173.7	5.1	109.6
11	R	34.5	Very low	36.8	Very low	244 Å²	244	161.6 Å²	161.6	92%	0.921	86%	0.855	S	S	*	*			trans	98.1	118.2	179.2	-63.7	178.2	160.9	-178.3	-4.5	116.3
12	R	34.9	Very low	36.6	Very low	253 Å²	253	159 Å²	159	96%	0.955	84%	0.842	S	S	*	*				-162.9	150.7	102.6	-104.4	172.1	175.2	-178.9	-2	111.9
13	K	36.6	Very low	36.1	Very low	219 Å²	219	158.3 Å²	158.3	95%	0.952	84%	0.842	S	S	*	*			trans	-119.7	145.7	169.5	-109.9	-173.6	177.7	-179.5	0	107.6
14	G	29.7	Very low	36.3	Very low	71 Å²	71	154.4 Å²	154.4	73%	0.732	84%	0.839	S	S	*	*			trans	142.3	103.5	171.6	0	0	0	0	0	110.5
15	R	35.8	Very low	36.8	Very low	255 Å²	255	154 Å²	154	96%	0.962	84%	0.84	S	S	*	*				88.9	108.3	71.4	-95.6	-166.4	172.6	-175.5	-0	113.1
16	S	33.3	Very low	37.6	Very low	127 Å²	127	150.2 Å²	150.2	89%	0.888	84%	0.835	S	S	*	*			trans	-155.5	157.3	148.2	44.2	0	0	0	0	109.5
17	R	34.3	Very low	37.5	Very low	239 Å²	239	145.5 Å²	145.5	90%	0.902	83%	0.826	S	S	*	*			trans	-116.3	-156.4	-172.4	-71.2	172.2	143.1	-176.3	-6.1	109.5
18	P	58.8	Low	37.3	Very low	115 Å²	115	150.3 Å²	150.3	75%	0.747	83%	0.826	S	S	*	*				-116.7	-142	-84.1	40.3	-21.2	0	0	0	109.1
19	P	51.3	Low	37.2	Very low	105 Å²	105	152.8 Å²	152.8	68%	0.682	83%	0.825	S	S	*	*			cis	-137.8	-171.7	-13.7	36.5	-14.3	0	0	0	116.5
20	S	33.7	Very low	37	Very low	98 Å²	98	159.8 Å²	159.8	69%	0.685	82%	0.824	S	S	*	*			trans	63.5	136.5	152.9	47.1	0	0	0	0	120.4
21	S	34.6	Very low	36.8	Very low	104 Å²	104	155.2 Å²	155.2	73%	0.727	82%	0.818	S	S	*	*			cis	91.9	128.6	17.8	82.8	0	0	0	0	117.7
22	M	31.4	Very low	36.7	Very low	185 Å²	185	152.2 Å²	152.2	91%	0.911	81%	0.814	S	S	*	*			trans	72.4	151.4	173.8	-70.8	-178	157.2	0	0	116.9
23	S	27.2	Very low	36.5	Very low	101 Å²	101	147.6 Å²	147.6	71%	0.706	80%	0.804	S	S	*	*			cis	-172.4	162.8	-19	50.7	0	0	0	0	110.3
24	A	39.3	Very low	36.3	Very low	93 Å²	93	142.9 Å²	142.9	77%	0.769	79%	0.789	S	S	*	*			trans	-73	161.5	165.2	0	0	0	0	0	112
25	P	49	Very low	36.5	Very low	120 Å²	120	146.4 Å²	146.4	78%	0.779	79%	0.791	S	S	*	*				-158.8	-157.3	103.9	42.3	-22.4	0	0	0	113.3
26	P	52.9	Low	36.7	Very low	113 Å²	113	139.3 Å²	139.3	73%	0.734	78%	0.778	S	S	*	*			cis	-115	161	-31.4	15.2	8.3	0	0	0	112.2
27	G	32.6	Very low	36.5	Very low	70 Å²	70	141 Å²	141	72%	0.722	77%	0.773	S	S	*	*				93.4	136.5	66.4	0	0	0	0	0	110.1
28	Y	32	Very low	36.3	Very low	225 Å²	225	136.1 Å²	136.1	88%	0.882	77%	0.766	S	S	*	*			cis	-141.1	-168.7	20.2	-87	-96.3	0	0	0	109.9
29	T	32	Very low	36.1	Very low	138 Å²	138	135.4 Å²	135.4	85%	0.847	76%	0.761	S	S	*	*			cis	-143.4	174.2	10	-28.5	0	0	0	0	111.3
30	R	28.5	Very low	35	Very low	232 Å²	232	137.5 Å²	137.5	88%	0.875	77%	0.766	S	S	*	*			trans	-123.9	150	-160.9	178.1	-164	-163.6	-174	5.9	112.3
31	L	31.3	Very low	34.9	Very low	152 Å²	152	143.2 Å²	143.2	80%	0.796	77%	0.772	S	S	*	*			trans	169.7	144.3	152	-91.9	168.2	0	0	0	106.8
32	E	31.2	Very low	34.8	Very low	182 Å²	182	145.4 Å²	145.4	85%	0.85	77%	0.774	S	S	*	*			cis	-152.6	-168.9	-22.6	-149.5	168.7	-152.7	0	0	108.5
33	Q	31	Very low	34.8	Very low	156 Å²	156	142.6 Å²	142.6	73%	0.729	77%	0.773	S	S	*	*			trans	-114.3	154.8	-156	-128.3	-170.7	-73.1	0	0	116.2
34	N	32	Very low	35.1	Very low	120 Å²	120	144.1 Å²	144.1	64%	0.642	78%	0.778	S	S	*	*			trans	70	152.8	157.4	-54.5	-17.3	0	0	0	117
35	D	33.4	Very low	34.7	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	78%	0.779	S	S	*	*			cis	-156.6	-174.5	4.2	-119.8	-5.3	0	0	0	111
36	P	41	Very low	33.8	Very low	106 Å²	106	141.5 Å²	141.5	69%	0.688	78%	0.781	S	S	*	*			trans	-113.8	174.2	-149.2	44.3	-41.2	0	0	0	119.9
37	M	28.4	Very low	33	Very low	161 Å²	161	144.3 Å²	144.3	79%	0.793	79%	0.789	S	S	*	*			trans	66	99.5	143.8	-76.5	-81.2	-80.9	0	0	123.1
38	N	31	Very low	33.4	Very low	138 Å²	138	146.4 Å²	146.4	74%	0.738	79%	0.79	S	S	*	*				76.8	169.8	125.2	-118.9	3	0	0	0	119.8
39	P	54.3	Low	33.5	Very low	100 Å²	100	144.1 Å²	144.1	65%	0.649	79%	0.79	S	S	*	*				-124	178.9	-117.8	40	-22.7	0	0	0	114.3
40	L	29	Very low	33.9	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	79%	0.794	S	S	*	*			trans	-178.7	155.6	151.1	-106.8	165.3	0	0	0	116.2
41	R	31.1	Very low	34.3	Very low	217 Å²	217	139.8 Å²	139.8	82%	0.819	79%	0.791	S	S	*	*			trans	74.5	119	165.4	-38.4	-156.1	176.7	-172.8	-2.6	116.6
42	I	33.1	Very low	34.7	Very low	151 Å²	151	138 Å²	138	77%	0.774	79%	0.792	S	S	*	*			cis	65	111.6	45.5	-52.1	174.8	0	0	0	113	V44	I42-V44 HydrophobicContact CG2-CG2 4.16Å
43	S	30	Very low	34.9	Very low	126 Å²	126	137.9 Å²	137.9	88%	0.881	79%	0.793	S	S	*	*			trans	-135	147.6	153.7	-169.2	0	0	0	0	109
44	V	34.8	Very low	35.5	Very low	133 Å²	133	135 Å²	135	81%	0.806	80%	0.796	S	S	*	*			trans	-121.5	139.7	-169.8	174.7	0	0	0	0	109	I42	I42-V44 HydrophobicContact CG2-CG2 4.16Å
45	G	29.7	Very low	35.9	Very low	77 Å²	77	134.6 Å²	134.6	79%	0.794	80%	0.802	S	S	*	*			trans	168.8	114.8	164.3	0	0	0	0	0	116.6
46	G	30.5	Very low	36.5	Very low	80 Å²	80	133.6 Å²	133.6	83%	0.825	80%	0.804	S	S	*	*			trans	99.7	86.8	147.5	0	0	0	0	0	118.2
47	L	35.9	Very low	37	Very low	172 Å²	172	134.2 Å²	134.2	90%	0.901	81%	0.806	S	S	*	*			trans	-78.8	150	146.5	-83.6	164.7	0	0	0	109.3
48	P	41.2	Very low	38	Very low	114 Å²	114	129.6 Å²	129.6	74%	0.74	78%	0.784	S	S	*	*				-135.9	137.2	122.1	35.7	-25.7	0	0	0	114.7
49	M	33.8	Very low	39.2	Very low	178 Å²	178	128.2 Å²	128.2	88%	0.877	78%	0.783	S	S	*	*			trans	42.1	127.3	142.8	-72.3	-67.5	179.4	0	0	121.8
50	L	41.9	Very low	39.3	Very low	180 Å²	180	133.2 Å²	133.2	94%	0.942	79%	0.789	S	S	*	*			trans	-55.5	130	160.1	-71.7	157	0	0	0	111.9
51	A	35.3	Very low	40.6	Very low	98 Å²	98	134.8 Å²	134.8	81%	0.81	79%	0.79	S	S	*	*			trans	-122.7	117.6	162.4	0	0	0	0	0	109.7
52	S	40	Very low	41.9	Very low	116 Å²	116	133.9 Å²	133.9	81%	0.811	79%	0.786	S	S	*	*			trans	-63.6	130.9	165.7	172.3	0	0	0	0	110.1
53	M	34.7	Very low	43	Very low	178 Å²	178	131.9 Å²	131.9	88%	0.877	78%	0.777	S	S	*	*			trans	-157.9	133.8	151.9	-102.9	-60.5	133.3	0	0	109.4	S55	M53-S55 PolarHBondContact O-N 2.93Å
54	A	45.3	Very low	44.8	Very low	95 Å²	95	133.6 Å²	133.6	79%	0.785	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-76.3	121.2	179.1	0	0	0	0	0	110.9
55	S	38.8	Very low	46.3	Very low	112 Å²	112	135.6 Å²	135.6	78%	0.783	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-69.6	130	169.8	-67.7	0	0	0	0	110.5	M53 T57	M53-S55 PolarHBondContact O-N 2.93Å; S55-T57 PolarHBondContact O-N 3.32Å
56	P	47.7	Very low	48.2	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-68.9	130.6	177	28.4	-33.6	0	0	0	110.4	D58	P56-D58 PolarHBondContact O-N 3.2Å
57	T	50.5	Low	50.2	Low	119 Å²	119	142.1 Å²	142.1	73%	0.73	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-59	129.3	176.2	50.6	0	0	0	0	111.5	S55	S55-T57 PolarHBondContact O-N 3.32Å
58	D	50.1	Low	52	Low	63 Å²	63	137.9 Å²	137.9	34%	0.337	72%	0.724	S	S	.	*	P	Polyproline II helix	trans	-51	126.6	175.4	-173.6	-42.6	0	0	0	110.6	P56 R60 F61	P56-D58 PolarHBondContact O-N 3.2Å; D58-R60 PolarHBondContact O-N 3.1Å; D58-R60 VanDerWaalsContact OD1-CB 3.26Å; D58-R60 WeakPolarHBondContact OD1-CB 3.33Å; D58-R60 WeakPolarHBondContact OD1-CG 3.4Å; D58-R60 IonicContact OD1-CZ 3.8Å; D58-R60 PolarHBondContact OD1-N 3.05Å; D58-R60 IonicContact OD1-NE 3.61Å; D58-R60 PolarHBondContact OD1-NE 3Å; D58-R60 IonicContact OD1-NH2 2.7Å; D58-R60 IonicContact OD2-CZ 3.4Å; D58-R60 IonicContact OD2-NE 3.59Å; D58-R60 PolarHBondContact OD2-NE 3.37Å; D58-R60 IonicContact OD2-NH2 2.74Å; D58-R60 PolarHBondContact OD2-NH2 2.56Å; D58-F61 PolarHBondContact O-N 2.7Å; D58-F61 VanDerWaalsContact O-N 3.12Å
59	P	55.3	Low	53.8	Low	110 Å²	110	137 Å²	137	71%	0.714	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-11	-176	24.7	-34.6	0	0	0	114.3
60	R	57.2	Low	56	Low	205 Å²	205	131 Å²	131	77%	0.774	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-18.7	177.2	-65.6	172.2	-74.5	-170.4	-0.5	114.2	D58	D58-R60 PolarHBondContact O-N 3.1Å; D58-R60 VanDerWaalsContact OD1-CB 3.26Å; D58-R60 WeakPolarHBondContact OD1-CB 3.33Å; D58-R60 WeakPolarHBondContact OD1-CG 3.4Å; D58-R60 IonicContact OD1-CZ 3.8Å; D58-R60 PolarHBondContact OD1-N 3.05Å; D58-R60 IonicContact OD1-NE 3.61Å; D58-R60 PolarHBondContact OD1-NE 3Å; D58-R60 IonicContact OD1-NH2 2.7Å; D58-R60 IonicContact OD2-CZ 3.4Å; D58-R60 IonicContact OD2-NE 3.59Å; D58-R60 PolarHBondContact OD2-NE 3.37Å; D58-R60 IonicContact OD2-NH2 2.74Å; D58-R60 PolarHBondContact OD2-NH2 2.56Å
61	F	55.9	Low	58	Low	182 Å²	182	126.8 Å²	126.8	80%	0.798	68%	0.677	S	S	*	*			trans	-110.1	45.8	-177.5	-75.6	-81.8	0	0	0	114	D58 L63	D58-F61 PolarHBondContact O-N 2.7Å; D58-F61 VanDerWaalsContact O-N 3.12Å; F61-L63 PolarHBondContact O-N 3.22Å
62	R	57.4	Low	60.3	Low	197 Å²	197	123.8 Å²	123.8	74%	0.743	66%	0.655	S	S	*	*			trans	-79.1	114.6	163.8	-69.4	-165.9	-178.2	-100.7	0.5	110.1	K64	R62-K64 PolarHBondContact O-N 3.23Å
63	L	57.3	Low	62.4	Low	110 Å²	110	120.7 Å²	120.7	58%	0.576	64%	0.637	S	S	*	*			trans	-55.2	105.3	171.5	-170.9	67.8	0	0	0	109.3	F61 W65 I68	F61-L63 PolarHBondContact O-N 3.22Å; L63-W65 HydrophobicContact CD2-CD2 4.35Å; L63-W65 HydrophobicContact CD2-CH2 4.23Å; L63-W65 HydrophobicContact CD2-CZ2 3.67Å; L63-W65 VanDerWaalsContact O-CD1 3.24Å; L63-W65 PolarHBondContact O-N 2.86Å; L63-I68 HydrophobicContact CD1-CD1 3.52Å; L63-I68 HydrophobicContact CD2-CD1 4.32Å; L63-I68 HydrophobicContact CG-CD1 3.77Å
64	K	66.9	Low	64.7	Low	162 Å²	162	115.7 Å²	115.7	70%	0.704	62%	0.62	S	S	*	*			trans	-76	91.5	-179.6	-64.5	-175.7	-176.4	175.9	0	107.9	R62 R66 P67	R62-K64 PolarHBondContact O-N 3.23Å; K64-R66 PolarHBondContact O-N 3.49Å; K64-P67 HydrophobicContact CB-CG 3.81Å; K64-P67 WeakPolarHBondContact O-CD 3.31Å; K64-P67 WeakPolarHBondContact O-CG 3.4Å
65	W	67.7	Low	66.6	Low	174 Å²	174	116.8 Å²	116.8	66%	0.659	61%	0.612	S	S	*	*	H	α-helix	trans	-58.5	-29.3	179.8	-72.9	95.1	0	0	0	113.6	L63 I68 V69	L63-W65 HydrophobicContact CD2-CD2 4.35Å; L63-W65 HydrophobicContact CD2-CH2 4.23Å; L63-W65 HydrophobicContact CD2-CZ2 3.67Å; L63-W65 VanDerWaalsContact O-CD1 3.24Å; L63-W65 PolarHBondContact O-N 2.86Å; W65-I68 PolarHBondContact O-N 3.45Å; W65-V69 WeakPolarHBondContact O-CB 3.13Å; W65-V69 WeakPolarHBondContact O-CG2 3.35Å; W65-V69 PolarHBondContact O-N 2.71Å
66	R	68.1	Low	68.7	Low	222 Å²	222	115.3 Å²	115.3	84%	0.838	60%	0.598	S	S	*	*	H	α-helix	trans	-56.4	-56.2	-179.9	-74.4	-179	167.1	-177.3	-5.3	114.1	K64 I68 V69 A70	K64-R66 PolarHBondContact O-N 3.49Å; R66-I68 VanDerWaalsContact C-N 3.32Å; R66-I68 PolarHBondContact O-N 2.69Å; R66-V69 PolarHBondContact O-N 2.81Å; R66-A70 WeakPolarHBondContact O-CB 3.46Å; R66-A70 PolarHBondContact O-N 3.4Å
67	P	72.9	Confident	70.7	Confident	72 Å²	72	115.8 Å²	115.8	47%	0.468	59%	0.588	S	S	.	*	H	α-helix	trans	-63.3	-32.3	174.5	21.4	-33.3	0	0	0	113.8	K64 A70 V71	K64-P67 HydrophobicContact CB-CG 3.81Å; K64-P67 WeakPolarHBondContact O-CD 3.31Å; K64-P67 WeakPolarHBondContact O-CG 3.4Å; P67-A70 PolarHBondContact O-N 3.33Å; P67-V71 WeakPolarHBondContact O-CG2 3.13Å; P67-V71 PolarHBondContact O-N 2.68Å
68	I	74.2	Confident	72.3	Confident	83 Å²	83	113.9 Å²	113.9	43%	0.426	58%	0.576	S	S	.	*	H	α-helix	trans	-66.2	-47.5	178.1	-61.7	170.6	0	0	0	110.6	L63 W65 R66 A70 V71 G72	L63-I68 HydrophobicContact CD1-CD1 3.52Å; L63-I68 HydrophobicContact CD2-CD1 4.32Å; L63-I68 HydrophobicContact CG-CD1 3.77Å; W65-I68 PolarHBondContact O-N 3.45Å; R66-I68 VanDerWaalsContact C-N 3.32Å; R66-I68 PolarHBondContact O-N 2.69Å; I68-A70 VanDerWaalsContact C-N 3.33Å; I68-A70 PolarHBondContact O-N 2.99Å; I68-V71 PolarHBondContact O-N 2.95Å; I68-G72 PolarHBondContact O-N 3.17Å
69	V	79	Confident	73.8	Confident	95 Å²	95	115.5 Å²	115.5	58%	0.576	58%	0.584	S	S	*	*	H	α-helix	trans	-63.3	-39.2	175	173.1	0	0	0	0	110.9	W65 R66 G72 A73	W65-V69 WeakPolarHBondContact O-CB 3.13Å; W65-V69 WeakPolarHBondContact O-CG2 3.35Å; W65-V69 PolarHBondContact O-N 2.71Å; R66-V69 PolarHBondContact O-N 2.81Å; V69-G72 PolarHBondContact O-N 2.83Å; V69-A73 VanDerWaalsContact O-CB 3.26Å; V69-A73 WeakPolarHBondContact O-CB 3.41Å; V69-A73 PolarHBondContact O-N 3.1Å
70	A	80.1	Confident	75	Confident	54 Å²	54	115 Å²	115	45%	0.446	57%	0.574	S	S	.	*	H	α-helix	trans	-63.7	-42.1	176.2	0	0	0	0	0	112.7	R66 P67 I68 S74	R66-A70 WeakPolarHBondContact O-CB 3.46Å; R66-A70 PolarHBondContact O-N 3.4Å; P67-A70 PolarHBondContact O-N 3.33Å; I68-A70 VanDerWaalsContact C-N 3.33Å; I68-A70 PolarHBondContact O-N 2.99Å; A70-S74 WeakPolarHBondContact O-CB 3.27Å; A70-S74 PolarHBondContact O-N 3.44Å; A70-S74 PolarHBondContact O-OG 2.9Å
71	V	83.1	Confident	76.1	Confident	90 Å²	90	108.4 Å²	108.4	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-67.5	-42.6	176.2	170.3	0	0	0	0	111.3	P67 I68 S74 L75	P67-V71 WeakPolarHBondContact O-CG2 3.13Å; P67-V71 PolarHBondContact O-N 2.68Å; I68-V71 PolarHBondContact O-N 2.95Å; V71-S74 PolarHBondContact O-N 2.83Å; V71-L75 HydrophobicContact CG1-CD1 3.99Å; V71-L75 PolarHBondContact O-N 2.49Å
72	G	83.4	Confident	77	Confident	35 Å²	35	105.2 Å²	105.2	36%	0.361	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-41.7	175.5	0	0	0	0	0	113.3	I68 V69 L75 T76	I68-G72 PolarHBondContact O-N 3.17Å; V69-G72 PolarHBondContact O-N 2.83Å; G72-L75 PolarHBondContact O-N 2.92Å; G72-T76 PolarHBondContact O-N 3.03Å; G72-T76 PolarHBondContact O-OG1 3.24Å
73	A	84.5	Confident	77.8	Confident	52 Å²	52	101.5 Å²	101.5	43%	0.43	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-41.3	174.7	0	0	0	0	0	112.1	V69 T76 F77	V69-A73 VanDerWaalsContact O-CB 3.26Å; V69-A73 WeakPolarHBondContact O-CB 3.41Å; V69-A73 PolarHBondContact O-N 3.1Å; A73-T76 WeakPolarHBondContact CA-OG1 3.21Å; A73-T76 PolarHBondContact O-N 2.77Å; A73-T76 PolarHBondContact O-OG1 2.85Å; A73-T76 VanDerWaalsContact O-OG1 3.07Å; A73-F77 VanDerWaalsContact O-CB 3.3Å; A73-F77 WeakPolarHBondContact O-CB 3.33Å; A73-F77 PolarHBondContact O-N 3.41Å
74	S	83.6	Confident	78.4	Confident	73 Å²	73	103.4 Å²	103.4	51%	0.51	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-43.5	175.4	-65.8	0	0	0	0	112.4	A70 V71 F77 V78	A70-S74 WeakPolarHBondContact O-CB 3.27Å; A70-S74 PolarHBondContact O-N 3.44Å; A70-S74 PolarHBondContact O-OG 2.9Å; V71-S74 PolarHBondContact O-N 2.83Å; S74-F77 PolarHBondContact O-N 2.98Å; S74-V78 WeakPolarHBondContact O-CG2 3.44Å; S74-V78 PolarHBondContact O-N 2.97Å
75	L	84.9	Confident	78.3	Confident	118 Å²	118	103.8 Å²	103.8	62%	0.618	55%	0.545	S	S	*	.	H	α-helix	trans	-64.3	-42.2	177.8	-82.6	163.1	0	0	0	112.4	V71 G72 V78 L79	V71-L75 HydrophobicContact CG1-CD1 3.99Å; V71-L75 PolarHBondContact O-N 2.49Å; G72-L75 PolarHBondContact O-N 2.92Å; L75-V78 PolarHBondContact O-N 3.06Å; L75-L79 PolarHBondContact O-N 3.16Å
76	T	83.8	Confident	77.8	Confident	81 Å²	81	98.5 Å²	98.5	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-68.4	-37.4	176	41.6	0	0	0	0	112.3	G72 A73 L79 L80	G72-T76 PolarHBondContact O-N 3.03Å; G72-T76 PolarHBondContact O-OG1 3.24Å; A73-T76 WeakPolarHBondContact CA-OG1 3.21Å; A73-T76 PolarHBondContact O-N 2.77Å; A73-T76 PolarHBondContact O-OG1 2.85Å; A73-T76 VanDerWaalsContact O-OG1 3.07Å; T76-L79 PolarHBondContact O-N 3.26Å; T76-L80 WeakPolarHBondContact O-CG 3.16Å; T76-L80 PolarHBondContact O-N 3.48Å
77	F	87.8	Confident	77.3	Confident	134 Å²	134	92.9 Å²	92.9	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-64.9	-40.5	173.7	-172.7	-111.1	0	0	0	112.6	A73 S74 L80 L81	A73-F77 VanDerWaalsContact O-CB 3.3Å; A73-F77 WeakPolarHBondContact O-CB 3.33Å; A73-F77 PolarHBondContact O-N 3.41Å; S74-F77 PolarHBondContact O-N 2.98Å; F77-L80 PolarHBondContact O-N 3.15Å; F77-L81 HydrophobicContact CD1-CD1 3.73Å; F77-L81 HydrophobicContact CE1-CD1 3.48Å; F77-L81 VanDerWaalsContact CE1-CD1 3.48Å; F77-L81 HydrophobicContact CE1-CG 4.27Å; F77-L81 HydrophobicContact CZ-CD1 4.05Å; F77-L81 HydrophobicContact CZ-CG 4.41Å; F77-L81 WeakPolarHBondContact O-CG 3.29Å; F77-L81 PolarHBondContact O-N 3.4Å
78	V	85.9	Confident	76.5	Confident	79 Å²	79	92.3 Å²	92.3	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-41.2	173.5	169.8	0	0	0	0	111.5	S74 L75 L81 L82	S74-V78 WeakPolarHBondContact O-CG2 3.44Å; S74-V78 PolarHBondContact O-N 2.97Å; L75-V78 PolarHBondContact O-N 3.06Å; V78-L81 PolarHBondContact O-N 3.15Å; V78-L82 HydrophobicContact CG1-CD1 4.12Å; V78-L82 WeakPolarHBondContact O-CG 3.5Å; V78-L82 PolarHBondContact O-N 2.65Å
79	L	81.3	Confident	75	Confident	97 Å²	97	99 Å²	99	51%	0.508	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-43.4	176.1	-166.9	76	0	0	0	111.7	L75 T76 L82 M83	L75-L79 PolarHBondContact O-N 3.16Å; T76-L79 PolarHBondContact O-N 3.26Å; L79-L82 PolarHBondContact O-N 2.83Å; L79-M83 WeakPolarHBondContact O-CG 3.12Å; L79-M83 PolarHBondContact O-N 2.75Å
80	L	80.7	Confident	73.5	Confident	99 Å²	99	100.5 Å²	100.5	52%	0.518	58%	0.581	S	S	.	*	H	α-helix	trans	-66.2	-37.9	176.4	-71.1	168.7	0	0	0	112.3	T76 F77 M83 H84	T76-L80 WeakPolarHBondContact O-CG 3.16Å; T76-L80 PolarHBondContact O-N 3.48Å; F77-L80 PolarHBondContact O-N 3.15Å; L80-M83 PolarHBondContact O-N 2.57Å; L80-H84 WeakPolarHBondContact O-CB 3.29Å; L80-H84 PolarHBondContact O-CD2 3Å; L80-H84 PolarHBondContact O-N 3.41Å
81	L	79.8	Confident	71.7	Confident	67 Å²	67	108.2 Å²	108.2	35%	0.351	60%	0.6	S	S	.	*	H	α-helix	trans	-62.7	-43	171.8	-79.7	165.7	0	0	0	111.8	F77 V78 M83 H84 F85	F77-L81 HydrophobicContact CD1-CD1 3.73Å; F77-L81 HydrophobicContact CE1-CD1 3.48Å; F77-L81 VanDerWaalsContact CE1-CD1 3.48Å; F77-L81 HydrophobicContact CE1-CG 4.27Å; F77-L81 HydrophobicContact CZ-CD1 4.05Å; F77-L81 HydrophobicContact CZ-CG 4.41Å; F77-L81 WeakPolarHBondContact O-CG 3.29Å; F77-L81 PolarHBondContact O-N 3.4Å; V78-L81 PolarHBondContact O-N 3.15Å; L81-M83 VanDerWaalsContact C-N 3.34Å; L81-M83 PolarHBondContact O-N 3.24Å; L81-H84 PolarHBondContact O-N 3.11Å; L81-F85 HydrophobicContact CB-CD2 4.39Å; L81-F85 HydrophobicContact CD2-CD2 4.38Å; L81-F85 HydrophobicContact CD2-CE2 3.77Å; L81-F85 WeakPolarHBondContact O-CB 3.32Å; L81-F85 WeakPolarHBondContact O-CD2 3.23Å; L81-F85 PolarHBondContact O-N 3.46Å
82	L	74.6	Confident	69.5	Low	116 Å²	116	107 Å²	107	61%	0.607	61%	0.606	S	S	*	*	H	α-helix	trans	-63.7	-38.9	176.4	-73.1	168.3	0	0	0	112	V78 L79 G86	V78-L82 HydrophobicContact CG1-CD1 4.12Å; V78-L82 WeakPolarHBondContact O-CG 3.5Å; V78-L82 PolarHBondContact O-N 2.65Å; L79-L82 PolarHBondContact O-N 2.83Å; L82-G86 PolarHBondContact O-N 3.26Å
83	M	74.4	Confident	67.6	Low	118 Å²	118	111.3 Å²	111.3	58%	0.581	63%	0.631	S	S	*	*	H	α-helix	trans	-67	-40.6	173.7	-71.6	-178.4	169.5	0	0	112.4	L79 L80 L81 S87	L79-M83 WeakPolarHBondContact O-CG 3.12Å; L79-M83 PolarHBondContact O-N 2.75Å; L80-M83 PolarHBondContact O-N 2.57Å; L81-M83 VanDerWaalsContact C-N 3.34Å; L81-M83 PolarHBondContact O-N 3.24Å; M83-S87 WeakPolarHBondContact O-CB 3.33Å; M83-S87 PolarHBondContact O-N 2.85Å; M83-S87 PolarHBondContact O-OG 2.97Å
84	H	70.3	Confident	65.4	Low	150 Å²	150	117.5 Å²	117.5	69%	0.694	65%	0.651	S	S	*	*	H	α-helix	trans	-69.5	-36.2	176	-85.7	-60.8	0	0	0	113.8	L80 L81	L80-H84 WeakPolarHBondContact O-CB 3.29Å; L80-H84 PolarHBondContact O-CD2 3Å; L80-H84 PolarHBondContact O-N 3.41Å; L81-H84 PolarHBondContact O-N 3.11Å
85	F	64	Low	63.6	Low	170 Å²	170	118 Å²	118	75%	0.746	67%	0.667	S	S	*	*	H	α-helix	trans	-82	-23.1	175.8	-73.2	-58.5	0	0	0	113.8	L81	L81-F85 HydrophobicContact CB-CD2 4.39Å; L81-F85 HydrophobicContact CD2-CD2 4.38Å; L81-F85 HydrophobicContact CD2-CE2 3.77Å; L81-F85 WeakPolarHBondContact O-CB 3.32Å; L81-F85 WeakPolarHBondContact O-CD2 3.23Å; L81-F85 PolarHBondContact O-N 3.46Å
86	G	57.9	Low	61.1	Low	63 Å²	63	124 Å²	124	65%	0.649	68%	0.682	S	S	*	*	H	α-helix	trans	-74.9	-24.1	171.8	0	0	0	0	0	113.8	L82 G88	L82-G86 PolarHBondContact O-N 3.26Å; G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 2.79Å
87	S	57.7	Low	58.9	Low	104 Å²	104	130.8 Å²	130.8	73%	0.727	70%	0.698	S	S	*	*	S	Bend	trans	-90.9	50.4	-176.1	-55.9	0	0	0	0	112.6	M83	M83-S87 WeakPolarHBondContact O-CB 3.33Å; M83-S87 PolarHBondContact O-N 2.85Å; M83-S87 PolarHBondContact O-OG 2.97Å
88	G	55.9	Low	56.7	Low	61 Å²	61	130.4 Å²	130.4	63%	0.629	71%	0.71	S	S	*	*			trans	-164.2	25.5	-165	0	0	0	0	0	119.4	G86	G86-G88 VanDerWaalsContact C-N 3.32Å; G86-G88 PolarHBondContact O-N 2.79Å
89	R	42.9	Very low	54.5	Low	223 Å²	223	131.3 Å²	131.3	84%	0.842	72%	0.718	S	S	*	*			trans	-137.5	78.4	167.3	-76.1	-167.3	175.8	174.5	-0.4	113.1	Y91	R89-Y91 PolarHBondContact O-N 2.93Å
90	S	46.1	Very low	52.8	Low	126 Å²	126	137.4 Å²	137.4	88%	0.881	73%	0.734	S	S	*	*			trans	-75.1	109.7	151.4	-167.1	0	0	0	0	107.4
91	Y	42.5	Very low	51	Low	216 Å²	216	138.6 Å²	138.6	85%	0.847	74%	0.741	S	S	*	*			trans	-110.2	129.7	167.8	-112.8	-92.9	0	0	0	108.4	R89	R89-Y91 PolarHBondContact O-N 2.93Å
92	G	37.1	Very low	49.3	Very low	64 Å²	64	139.4 Å²	139.4	66%	0.66	75%	0.753	S	S	*	*			trans	-78	166.3	-156.9	0	0	0	0	0	115.8	Q94	G92-Q94 PolarHBondContact O-N 2.78Å; G92-Q94 VanDerWaalsContact O-N 3.1Å
93	S	44.1	Very low	47.9	Very low	127 Å²	127	137 Å²	137	89%	0.888	75%	0.75	S	S	*	*			trans	-61.6	104.7	166.9	53.9	0	0	0	0	111.3
94	Q	38.8	Very low	46.6	Very low	181 Å²	181	136.3 Å²	136.3	85%	0.846	75%	0.752	S	S	*	*			trans	-120.4	127.8	154.7	-79.3	-170.7	-21.8	0	0	108.9	G92 W96	G92-Q94 PolarHBondContact O-N 2.78Å; G92-Q94 VanDerWaalsContact O-N 3.1Å; Q94-W96 PolarHBondContact O-N 2.86Å
95	G	46.3	Very low	45.4	Very low	83 Å²	83	139.2 Å²	139.2	86%	0.856	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-67.7	119.7	-158.8	0	0	0	0	0	113.9
96	W	32	Very low	44.7	Very low	246 Å²	246	136.1 Å²	136.1	93%	0.932	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-92.9	123.9	151	-77.8	52.6	0	0	0	107.1	Q94	Q94-W96 PolarHBondContact O-N 2.86Å
97	R	37.8	Very low	44.4	Very low	222 Å²	222	136.5 Å²	136.5	84%	0.838	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-61.4	128	176.1	-66.9	178.6	175.4	-166	-1.7	108.3	C99	R97-C99 PolarHBondContact O-N 2.55Å
98	P	39.8	Very low	44.5	Very low	127 Å²	127	138.3 Å²	138.3	83%	0.825	75%	0.746	S	S	*	*			trans	-73.7	80.4	170.2	30.8	-33.2	0	0	0	109.1	R100	P98-R100 VanDerWaalsContact C-N 3.34Å; P98-R100 PolarHBondContact O-N 2.93Å
99	C	41.4	Very low	45.4	Very low	97 Å²	97	137.8 Å²	137.8	66%	0.655	73%	0.733	S	S	*	*			trans	-72.6	92.8	164.5	-77.1	0	0	0	0	108.9	R97 D101	R97-C99 PolarHBondContact O-N 2.55Å; C99-D101 VanDerWaalsContact C-N 3.31Å; C99-D101 PolarHBondContact O-N 2.82Å
100	R	45.8	Very low	47.8	Very low	225 Å²	225	134.2 Å²	134.2	85%	0.849	73%	0.726	S	S	*	*	S	Bend	trans	63.5	6.6	146	-141.1	177.3	-173.9	-179.9	0.7	120	P98	P98-R100 VanDerWaalsContact C-N 3.34Å; P98-R100 PolarHBondContact O-N 2.93Å
101	D	41.6	Very low	50.3	Low	125 Å²	125	129.9 Å²	129.9	67%	0.668	69%	0.69	S	S	*	*			trans	-91.1	-10.9	-179.6	-81.1	-17.8	0	0	0	116.2	C99	C99-D101 VanDerWaalsContact C-N 3.31Å; C99-D101 PolarHBondContact O-N 2.82Å
102	S	43.4	Very low	52.9	Low	84 Å²	84	122.6 Å²	122.6	59%	0.587	67%	0.666	S	S	*	*	H	α-helix	trans	-68	-40.3	177.9	51.8	0	0	0	0	112.6	V104 R105 D106	S102-V104 PolarHBondContact O-N 2.88Å; S102-R105 PolarHBondContact O-N 2.85Å; S102-R105 VanDerWaalsContact O-N 3.1Å; S102-D106 PolarHBondContact O-N 2.87Å
103	A	46.1	Very low	55.8	Low	66 Å²	66	125.9 Å²	125.9	55%	0.545	67%	0.668	S	S	.	*	H	α-helix	trans	-62.5	-25.3	-179.7	0	0	0	0	0	113.7	A107	A103-A107 WeakPolarHBondContact O-CB 3.38Å; A103-A107 PolarHBondContact O-N 2.68Å
104	V	47.1	Very low	58.4	Low	102 Å²	102	122.9 Å²	122.9	62%	0.618	65%	0.645	S	S	*	*	H	α-helix	trans	-79.2	-26.8	178.8	-174.6	0	0	0	0	111.5	S102	S102-V104 PolarHBondContact O-N 2.88Å
105	R	44.2	Very low	61.2	Low	211 Å²	211	119.1 Å²	119.1	80%	0.796	62%	0.624	S	S	*	*	H	α-helix	trans	-83.9	-30.9	176.5	-69.2	-172.5	178.1	-170.7	-0.3	113.3	S102	S102-R105 PolarHBondContact O-N 2.85Å; S102-R105 VanDerWaalsContact O-N 3.1Å
106	D	49.2	Very low	63.7	Low	106 Å²	106	115.8 Å²	115.8	57%	0.567	59%	0.587	S	S	*	*	H	α-helix	trans	-73.9	-34.1	175.4	-71.9	-33.9	0	0	0	112.1	S102 D108 S109	S102-D106 PolarHBondContact O-N 2.87Å; D106-D108 VanDerWaalsContact C-N 3.3Å; D106-D108 PolarHBondContact O-N 2.84Å; D106-S109 WeakPolarHBondContact O-CB 3.41Å; D106-S109 PolarHBondContact O-N 2.91Å; D106-S109 PolarHBondContact O-OG 2.93Å
107	A	52.2	Low	66.9	Low	71 Å²	71	106.5 Å²	106.5	59%	0.587	56%	0.555	S	S	*	*	H	α-helix	trans	-62	-32.7	180	0	0	0	0	0	114	A103 S109	A103-A107 WeakPolarHBondContact O-CB 3.38Å; A103-A107 PolarHBondContact O-N 2.68Å; A107-S109 PolarHBondContact O-N 2.87Å
108	D	60	Low	69.7	Low	141 Å²	141	98.3 Å²	98.3	75%	0.754	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.3	177	-137.7	19.9	0	0	0	112.3	D106	D106-D108 VanDerWaalsContact C-N 3.3Å; D106-D108 PolarHBondContact O-N 2.84Å
109	S	75.1	Confident	72.5	Confident	50 Å²	50	97.2 Å²	97.2	35%	0.35	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-21.4	-177.8	84.5	0	0	0	0	114.1	D106 A107 F277 R278	D106-S109 WeakPolarHBondContact O-CB 3.41Å; D106-S109 PolarHBondContact O-N 2.91Å; D106-S109 PolarHBondContact O-OG 2.93Å; A107-S109 PolarHBondContact O-N 2.87Å; S109-F277 WeakPolarHBondContact O-CZ 3.4Å; S109-R278 PolarHBondContact O-NH2 3.28Å
110	Q	93.7	Very high	75.2	Confident	148 Å²	148	95 Å²	95	69%	0.692	51%	0.508	S	S	*	.	S	Bend	trans	-104.1	146.5	-176	-172.4	175.6	-7.2	0	0	111
111	Y	97.3	Very high	77.7	Confident	35 Å²	35	87.8 Å²	87.8	14%	0.137	48%	0.484	C	S	.	.			trans	-66	137	171.2	-177.7	-108.6	0	0	0	111.1	D113 F197 N198 E246 F277	Y111-D113 HydrophobicContact CD1-CB 4.26Å; Y111-D113 HydrophobicContact CE1-CB 4.18Å; Y111-F197 AromaticContact CE2-CD2 3.8Å; Y111-F197 HydrophobicContact CE2-CD2 3.8Å; Y111-F197 AromaticContact CE2-CE2 3.5Å; Y111-F197 HydrophobicContact CE2-CE2 3.5Å; Y111-F197 HydrophobicContact CE2-CZ 4.13Å; Y111-F197 WeakPolarHBondContact OH-CD2 3.39Å; Y111-N198 HydrophobicContact CD2-CB 4.04Å; Y111-N198 HydrophobicContact CE2-CB 3.73Å; Y111-N198 PolarHBondContact OH-N 2.88Å; Y111-E246 VanDerWaalsContact CB-CD 3.45Å; Y111-E246 HydrophobicContact CD1-CB 4.1Å; Y111-E246 HydrophobicContact CD1-CG 3.65Å; Y111-E246 HydrophobicContact CD2-CB 3.96Å; Y111-E246 HydrophobicContact CD2-CG 4.39Å; Y111-E246 HydrophobicContact CE1-CB 4.48Å; Y111-E246 HydrophobicContact CE1-CG 4.2Å; Y111-E246 HydrophobicContact CE2-CB 4.34Å; Y111-E246 HydrophobicContact CG-CB 3.83Å; Y111-E246 HydrophobicContact CG-CG 3.76Å; Y111-F277 HydrophobicContact CD2-CB 3.61Å; Y111-F277 AromaticContact CD2-CD1 3.98Å; Y111-F277 HydrophobicContact CD2-CD1 3.98Å; Y111-F277 AromaticContact CD2-CG 3.86Å; Y111-F277 HydrophobicContact CD2-CG 3.86Å; Y111-F277 HydrophobicContact CE2-CB 4.1Å; Y111-F277 HydrophobicContact CG-CD1 4.49Å
112	N	97.9	Very high	80.3	Confident	63 Å²	63	92.2 Å²	92.2	34%	0.337	49%	0.491	S	S	.	.			trans	-95.9	109.3	172	-177.8	-0.4	0	0	0	110.5	T114 N198 G199	N112-T114 VanDerWaalsContact C-N 3.31Å; N112-T114 PolarHBondContact O-N 2.84Å; N112-T114 VanDerWaalsContact OD1-CB 3.28Å; N112-T114 WeakPolarHBondContact OD1-CB 3.31Å; N112-T114 PolarHBondContact OD1-N 3Å; N112-T114 PolarHBondContact OD1-OG1 2.97Å; N112-N198 WeakPolarHBondContact CB-OD1 3.26Å; N112-N198 PolarHBondContact N-OD1 2.98Å; N112-N198 CarbonylContact O-C 3.52Å; N112-N198 VanDerWaalsContact O-CA 3.29Å; N112-N198 WeakPolarHBondContact O-CA 3.48Å; N112-G199 PolarHBondContact O-N 2.83Å
113	D	97.8	Very high	82.9	Confident	133 Å²	133	90 Å²	90	71%	0.711	47%	0.474	S	S	*	.			trans	-84.6	8	-178.2	64.8	-20.9	0	0	0	114.6	Y111 Y115	Y111-D113 HydrophobicContact CD1-CB 4.26Å; Y111-D113 HydrophobicContact CE1-CB 4.18Å; D113-Y115 PolarHBondContact O-N 2.93Å
114	T	98.4	Very high	85.3	Confident	65 Å²	65	92 Å²	92	40%	0.399	48%	0.484	S	S	.	.			trans	-57.1	108.3	177.7	-58.8	0	0	0	0	111.9	N112	N112-T114 VanDerWaalsContact C-N 3.31Å; N112-T114 PolarHBondContact O-N 2.84Å; N112-T114 VanDerWaalsContact OD1-CB 3.28Å; N112-T114 WeakPolarHBondContact OD1-CB 3.31Å; N112-T114 PolarHBondContact OD1-N 3Å; N112-T114 PolarHBondContact OD1-OG1 2.97Å
115	Y	98.4	Very high	87.6	Confident	101 Å²	101	93.7 Å²	93.7	40%	0.396	49%	0.485	S	S	.	.			trans	-147.1	133.1	174.3	-174.6	-106.2	0	0	0	112.1	D113 V196 P375 E423 F424	D113-Y115 PolarHBondContact O-N 2.93Å; Y115-V196 HydrophobicContact CD2-CB 3.73Å; Y115-V196 HydrophobicContact CD2-CG1 3.79Å; Y115-V196 HydrophobicContact CD2-CG2 4.41Å; Y115-V196 HydrophobicContact CE2-CB 3.91Å; Y115-V196 HydrophobicContact CE2-CG1 4.47Å; Y115-V196 HydrophobicContact CE2-CG2 4.39Å; Y115-P375 HydrophobicContact CE1-CG 4.02Å; Y115-E423 WeakPolarHBondContact CE2-OE1 3.28Å; Y115-E423 PolarHBondContact OH-OE1 3.32Å; Y115-F424 HydrophobicContact CE2-CB 4.49Å
116	P	98.5	Very high	90.1	Very high	13 Å²	13	83.9 Å²	83.9	8%	0.084	45%	0.45	C	S	.	.	S	Bend	cis	-60.2	172.8	-16.1	-24.6	37.4	0	0	0	113.3	Y129 P375 F424	P116-Y129 HydrophobicContact CG-CD1 4.45Å; P116-P375 HydrophobicContact CG-CB 4.41Å; P116-P375 HydrophobicContact CG-CG 3.74Å; P116-F424 HydrophobicContact CB-CB 3.89Å; P116-F424 HydrophobicContact CG-CB 3.74Å
117	L	98.3	Very high	92.4	Very high	51 Å²	51	81.7 Å²	81.7	27%	0.267	44%	0.437	S	S	.	.	S	Bend	trans	-70.8	-37.6	177.1	-60.4	176.7	0	0	0	112.3	V196 G199 L201	L117-V196 HydrophobicContact CD1-CG2 3.79Å; L117-V196 HydrophobicContact CD2-CG1 3.65Å; L117-V196 HydrophobicContact CD2-CG2 4.29Å; L117-V196 HydrophobicContact CG-CB 4.49Å; L117-V196 HydrophobicContact CG-CG1 3.92Å; L117-V196 HydrophobicContact CG-CG2 3.64Å; L117-G199 WeakPolarHBondContact CD2-O 3.32Å; L117-L201 HydrophobicContact CD1-CB 3.94Å
118	T	98.3	Very high	94.6	Very high	51 Å²	51	81.4 Å²	81.4	31%	0.313	42%	0.421	S	S	.	.	S	Bend	trans	-94.1	123.8	173.4	-57.3	0	0	0	0	109.3	R130 I425	T118-R130 HydrophobicContact CG2-CB 4.13Å; T118-I425 WeakPolarHBondContact CA-O 3.42Å; T118-I425 WeakPolarHBondContact CB-O 3.26Å; T118-I425 WeakPolarHBondContact CB-OXT 3.44Å; T118-I425 VanDerWaalsContact N-C 3.33Å; T118-I425 PolarHBondContact N-O 2.96Å; T118-I425 PolarHBondContact N-OXT 3.05Å; T118-I425 PolarHBondContact OG1-O 2.7Å; T118-I425 PolarHBondContact OG1-OXT 3.15Å
119	P	98.3	Very high	96.5	Very high	103 Å²	103	75.1 Å²	75.1	67%	0.669	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-55	132.8	177.9	-28.4	36	0	0	0	112.8
120	P	98.1	Very high	97.6	Very high	51 Å²	51	74.4 Å²	74.4	33%	0.331	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-58.6	139.8	176.9	-26.1	34.8	0	0	0	113.4	M127 Y129	P120-M127 HydrophobicContact CB-CG 4.14Å; P120-M127 HydrophobicContact CB-SD 4.03Å; P120-Y129 HydrophobicContact CB-CD1 3.81Å; P120-Y129 HydrophobicContact CB-CE1 3.61Å; P120-Y129 HydrophobicContact CG-CD1 3.72Å; P120-Y129 HydrophobicContact CG-CE1 3.52Å
121	E	98	Very high	97.8	Very high	74 Å²	74	67.4 Å²	67.4	35%	0.346	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.4	-176.3	-65.8	-178.1	165.3	0	0	111.6	T123 M127 R128	E121-T123 PolarHBondContact O-N 3.16Å; E121-M127 VanDerWaalsContact C-SD 3.57Å; E121-R128 HydrophobicContact CB-CB 4.27Å; E121-R128 PolarHBondContact N-O 2.79Å; E121-R128 PolarHBondContact O-N 3.04Å; E121-R128 IonicContact OE2-CZ 3.42Å; E121-R128 IonicContact OE2-NE 3.2Å; E121-R128 PolarHBondContact OE2-NE 3.45Å; E121-R128 IonicContact OE2-NH2 2.81Å; E121-R128 PolarHBondContact OE2-NH2 2.67Å
122	R	97.2	Very high	97.9	Very high	217 Å²	217	65.7 Å²	65.7	82%	0.819	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	116.1	173.8	-169.9	175.5	-176.8	167.7	3	110.8	M127	R122-M127 HydrophobicContact CB-CE 4.32Å; R122-M127 HydrophobicContact CB-SD 4.05Å
123	T	96.7	Very high	97.9	Very high	38 Å²	38	62.7 Å²	62.7	23%	0.233	32%	0.321	C	S	.	.			trans	-106.3	173.4	178.4	74.9	0	0	0	0	111.7	E121 Q125 G126 R128	E121-T123 PolarHBondContact O-N 3.16Å; T123-Q125 PolarHBondContact O-N 2.78Å; T123-Q125 PolarHBondContact OG1-N 2.92Å; T123-Q125 VanDerWaalsContact OG1-N 3.16Å; T123-G126 WeakPolarHBondContact CA-O 3.5Å; T123-G126 PolarHBondContact N-O 3.24Å; T123-G126 PolarHBondContact OG1-N 2.9Å; T123-G126 PolarHBondContact OG1-O 2.95Å; T123-R128 HydrophobicContact CG2-CB 3.92Å
124	S	96	Very high	98	Very high	109 Å²	109	56.4 Å²	56.4	76%	0.762	29%	0.287	S	S	*	.	S	Bend	trans	-67.7	-17.9	170.3	54.9	0	0	0	0	113.8	Q162	S124-Q162 PolarHBondContact O-NE2 3.36Å
125	Q	95.3	Very high	98	Very high	136 Å²	136	53.3 Å²	53.3	64%	0.636	27%	0.268	S	S	*	.	S	Bend	trans	-98.1	-20	-179.3	-65.8	-178	-27.1	0	0	113.1	T123 L159 Q162	T123-Q125 PolarHBondContact O-N 2.78Å; T123-Q125 PolarHBondContact OG1-N 2.92Å; T123-Q125 VanDerWaalsContact OG1-N 3.16Å; Q125-L159 HydrophobicContact CB-CD1 4.44Å; Q125-L159 HydrophobicContact CB-CD2 3.95Å; Q125-Q162 PolarHBondContact O-N 2.66Å
126	G	96.9	Very high	98	Very high	6 Å²	6	48.7 Å²	48.7	6%	0.062	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.1	-153.3	-179.4	0	0	0	0	0	112.6	T123 V160	T123-G126 WeakPolarHBondContact CA-O 3.5Å; T123-G126 PolarHBondContact N-O 3.24Å; T123-G126 PolarHBondContact OG1-N 2.9Å; T123-G126 PolarHBondContact OG1-O 2.95Å; G126-V160 CarbonylContact C-O 3.5Å; G126-V160 VanDerWaalsContact CA-O 3.23Å; G126-V160 WeakPolarHBondContact CA-O 3.35Å
127	M	98.3	Very high	98	Very high	59 Å²	59	48.8 Å²	48.8	29%	0.291	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.2	-179.2	-163.3	66	78.2	0	0	110.7	P120 E121 R122 Y129 L159 V160	P120-M127 HydrophobicContact CB-CG 4.14Å; P120-M127 HydrophobicContact CB-SD 4.03Å; E121-M127 VanDerWaalsContact C-SD 3.57Å; R122-M127 HydrophobicContact CB-CE 4.32Å; R122-M127 HydrophobicContact CB-SD 4.05Å; M127-Y129 HydrophobicContact CB-CE2 3.79Å; M127-Y129 HydrophobicContact CG-CD2 4.37Å; M127-Y129 HydrophobicContact CG-CE1 4.24Å; M127-Y129 HydrophobicContact CG-CE2 3.53Å; M127-Y129 VanDerWaalsContact CG-CZ 3.46Å; M127-Y129 WeakPolarHBondContact CG-OH 3.13Å; M127-L159 WeakPolarHBondContact O-CA 3.36Å; M127-V160 PolarHBondContact N-O 3.29Å; M127-V160 PolarHBondContact O-N 3.06Å
128	R	98.4	Very high	98	Very high	66 Å²	66	48.1 Å²	48.1	25%	0.249	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.5	-179.6	-174.3	168.2	76.5	161.6	0.6	110.7	E121 T123 Y157 L158 L159 E170	E121-R128 HydrophobicContact CB-CB 4.27Å; E121-R128 PolarHBondContact N-O 2.79Å; E121-R128 PolarHBondContact O-N 3.04Å; E121-R128 IonicContact OE2-CZ 3.42Å; E121-R128 IonicContact OE2-NE 3.2Å; E121-R128 PolarHBondContact OE2-NE 3.45Å; E121-R128 IonicContact OE2-NH2 2.81Å; E121-R128 PolarHBondContact OE2-NH2 2.67Å; T123-R128 HydrophobicContact CG2-CB 3.92Å; R128-Y157 HydrophobicContact CG-CD1 3.76Å; R128-Y157 HydrophobicContact CG-CG 4.08Å; R128-L158 CarbonylContact C-O 3.52Å; R128-L158 VanDerWaalsContact CA-O 3.25Å; R128-L158 WeakPolarHBondContact CA-O 3.43Å; R128-L159 HydrophobicContact CB-CD1 4.17Å; R128-E170 IonicContact NH1-OE1 2.65Å; R128-E170 PolarHBondContact NH1-OE1 3Å
129	Y	98.8	Very high	97.9	Very high	9 Å²	9	49.7 Å²	49.7	4%	0.035	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.4	-177.7	-57.5	-97	0	0	0	110	P116 P120 M127 Y157 L158 V160 I374 P375 N376 F424	P116-Y129 HydrophobicContact CG-CD1 4.45Å; P120-Y129 HydrophobicContact CB-CD1 3.81Å; P120-Y129 HydrophobicContact CB-CE1 3.61Å; P120-Y129 HydrophobicContact CG-CD1 3.72Å; P120-Y129 HydrophobicContact CG-CE1 3.52Å; M127-Y129 HydrophobicContact CB-CE2 3.79Å; M127-Y129 HydrophobicContact CG-CD2 4.37Å; M127-Y129 HydrophobicContact CG-CE1 4.24Å; M127-Y129 HydrophobicContact CG-CE2 3.53Å; M127-Y129 VanDerWaalsContact CG-CZ 3.46Å; M127-Y129 WeakPolarHBondContact CG-OH 3.13Å; Y129-Y157 CarbonylContact O-C 3.58Å; Y129-Y157 VanDerWaalsContact O-CA 3.24Å; Y129-Y157 WeakPolarHBondContact O-CA 3.49Å; Y129-Y157 WeakPolarHBondContact O-CD1 3.21Å; Y129-L158 HydrophobicContact CD2-CD2 3.98Å; Y129-L158 PolarHBondContact N-O 3.07Å; Y129-L158 PolarHBondContact O-N 3.14Å; Y129-V160 HydrophobicContact CE2-CG2 4.05Å; Y129-I374 HydrophobicContact CE2-CG2 4.22Å; Y129-P375 HydrophobicContact CD1-CB 4.42Å; Y129-P375 HydrophobicContact CD1-CG 4.17Å; Y129-P375 HydrophobicContact CE1-CB 3.81Å; Y129-P375 HydrophobicContact CE1-CG 4.05Å; Y129-P375 PolarHBondContact OH-O 2.68Å; Y129-N376 PolarHBondContact OH-OD1 2.84Å; Y129-F424 HydrophobicContact CD1-CD1 4.42Å; Y129-F424 HydrophobicContact CG-CD1 4.17Å; Y129-F424 HydrophobicContact CG-CE1 4.23Å
130	R	98.8	Very high	97.9	Very high	35 Å²	35	50.1 Å²	50.1	13%	0.132	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.1	170.6	-163.3	71.4	173.5	137.1	-6.4	108.9	T118 G156 Y157 D172 F424 I425	T118-R130 HydrophobicContact CG2-CB 4.13Å; R130-G156 WeakPolarHBondContact CD-O 3.24Å; R130-G156 PolarHBondContact NH1-O 2.83Å; R130-Y157 HydrophobicContact CB-CD1 4.46Å; R130-Y157 HydrophobicContact CB-CE1 4.27Å; R130-Y157 VanDerWaalsContact CD-CZ 3.46Å; R130-Y157 HydrophobicContact CG-CE1 4.42Å; R130-Y157 VanDerWaalsContact NH1-CE2 3.26Å; R130-D172 IonicContact CZ-OD1 3Å; R130-D172 IonicContact CZ-OD2 3.2Å; R130-D172 IonicContact NH1-OD1 3.49Å; R130-D172 PolarHBondContact NH1-OD1 2.91Å; R130-D172 IonicContact NH1-OD2 3Å; R130-D172 IonicContact NH2-OD1 3.34Å; R130-D172 PolarHBondContact NH2-OD1 3.1Å; R130-D172 IonicContact NH2-OD2 2.93Å; R130-D172 PolarHBondContact NH2-OD2 3.29Å; R130-F424 WeakPolarHBondContact O-CA 3.34Å; R130-I425 HydrophobicContact CB-CG1 4.11Å; R130-I425 HydrophobicContact CG-CD1 4.09Å; R130-I425 HydrophobicContact CG-CG1 3.57Å; R130-I425 PolarHBondContact O-N 3.25Å
131	I	98.9	Very high	97.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	150.6	176.2	62.2	167.9	0	0	0	111.6	R155 G156 L158 V169 W171 E423 F424	I131-R155 CarbonylContact O-C 3.54Å; I131-R155 WeakPolarHBondContact O-CA 3.47Å; I131-G156 PolarHBondContact N-O 2.79Å; I131-G156 PolarHBondContact O-N 2.78Å; I131-L158 HydrophobicContact CD1-CB 4.45Å; I131-L158 HydrophobicContact CG2-CB 3.94Å; I131-V169 HydrophobicContact CD1-CG1 3.81Å; I131-V169 HydrophobicContact CD1-CG2 4.47Å; I131-W171 HydrophobicContact CD1-CH2 3.82Å; I131-W171 HydrophobicContact CD1-CZ2 4.43Å; I131-W171 HydrophobicContact CD1-CZ3 4.06Å; I131-W171 HydrophobicContact CG1-CZ3 4.35Å; I131-E423 CarbonylContact C-O 3.36Å; I131-E423 WeakPolarHBondContact CA-O 3.39Å; I131-F424 HydrophobicContact CG2-CD1 3.61Å; I131-F424 HydrophobicContact CG2-CE1 3.68Å; I131-F424 HydrophobicContact CG2-CG 4.42Å
132	G	98.7	Very high	97.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	144.6	170.1	0	0	0	0	0	110.8	R154 L422 E423	G132-R154 CarbonylContact C-O 3.45Å; G132-R154 WeakPolarHBondContact CA-O 3.26Å; G132-L422 WeakPolarHBondContact O-CA 3.49Å; G132-E423 PolarHBondContact N-O 2.95Å; G132-E423 PolarHBondContact O-N 3.48Å
133	V	98.9	Very high	97.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	144	164.3	-63	0	0	0	0	110	M153 R154 W171 L385 I414 Y419 G421 L422	V133-M153 CarbonylContact O-C 3.6Å; V133-M153 WeakPolarHBondContact O-CA 3.25Å; V133-R154 HydrophobicContact CG2-CB 3.82Å; V133-R154 PolarHBondContact N-O 2.66Å; V133-R154 PolarHBondContact O-N 3.29Å; V133-W171 HydrophobicContact CB-CH2 4.42Å; V133-W171 HydrophobicContact CG1-CH2 3.71Å; V133-W171 HydrophobicContact CG1-CZ3 4.24Å; V133-W171 HydrophobicContact CG2-CH2 3.78Å; V133-W171 HydrophobicContact CG2-CZ3 3.75Å; V133-L385 HydrophobicContact CB-CD1 4.33Å; V133-L385 HydrophobicContact CG1-CD1 3.91Å; V133-L385 HydrophobicContact CG1-CD2 4.21Å; V133-I414 HydrophobicContact CG2-CD1 4.37Å; V133-Y419 HydrophobicContact CB-CD1 4.01Å; V133-Y419 HydrophobicContact CB-CG 4.16Å; V133-Y419 HydrophobicContact CG2-CD1 3.58Å; V133-Y419 HydrophobicContact CG2-CD2 4.34Å; V133-Y419 HydrophobicContact CG2-CE1 3.87Å; V133-Y419 HydrophobicContact CG2-CG 3.85Å; V133-G421 CarbonylContact C-O 3.58Å; V133-G421 WeakPolarHBondContact CA-O 3.24Å; V133-G421 WeakPolarHBondContact CB-O 3.34Å; V133-L422 HydrophobicContact CG1-CB 4.32Å; V133-L422 HydrophobicContact CG1-CD1 3.6Å
134	I	98.9	Very high	97.8	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.6	-176.3	-153.9	158.2	0	0	0	110.9	Y152 M153 L178 L191 L194 Y419 E420 G421	I134-Y152 WeakPolarHBondContact CA-O 3.45Å; I134-M153 HydrophobicContact CG1-CB 4.36Å; I134-L178 HydrophobicContact CD1-CD1 3.67Å; I134-L178 HydrophobicContact CG1-CD1 4.36Å; I134-L191 HydrophobicContact CD1-CB 4.43Å; I134-L191 HydrophobicContact CD1-CD1 3.5Å; I134-L191 HydrophobicContact CG1-CB 4.23Å; I134-L191 HydrophobicContact CG1-CD1 3.91Å; I134-L191 HydrophobicContact CG2-CB 4.35Å; I134-L194 HydrophobicContact CB-CD1 4.31Å; I134-L194 HydrophobicContact CD1-CD1 4Å; I134-L194 HydrophobicContact CG2-CB 3.96Å; I134-L194 HydrophobicContact CG2-CD1 4.33Å; I134-Y419 CarbonylContact O-C 3.45Å; I134-Y419 VanDerWaalsContact O-CA 3.26Å; I134-Y419 WeakPolarHBondContact O-CA 3.49Å; I134-E420 PolarHBondContact O-N 2.66Å; I134-G421 PolarHBondContact N-O 2.91Å; I134-G421 PolarHBondContact O-N 2.95Å
135	A	98.7	Very high	97.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.9	-169.1	0	0	0	0	0	112.3	L137 S151 Y152 V417 K418 Y419	A135-L137 HydrophobicContact CB-CD2 4.17Å; A135-L137 HydrophobicContact CB-CG 4.49Å; A135-S151 PolarHBondContact O-OG 2.95Å; A135-Y152 WeakPolarHBondContact CB-O 3.46Å; A135-Y152 PolarHBondContact N-O 2.82Å; A135-V417 HydrophobicContact CB-CG2 4.36Å; A135-K418 CarbonylContact C-O 3.52Å; A135-K418 WeakPolarHBondContact CA-O 3.47Å; A135-Y419 HydrophobicContact CB-CD1 3.87Å; A135-Y419 HydrophobicContact CB-CE1 3.97Å
136	D	98.8	Very high	97.9	Very high	4 Å²	4	48 Å²	48	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135.1	151.3	-177.5	24.5	0	0	0	109	D138 E190 K418 E420	D136-D138 PolarHBondContact OD1-N 3.47Å; D136-E190 WeakPolarHBondContact OD1-CA 3.34Å; D136-E190 WeakPolarHBondContact OD1-CB 3.4Å; D136-E190 WeakPolarHBondContact OD1-CG 3.44Å; D136-K418 PolarHBondContact N-O 3.48Å; D136-K418 VanDerWaalsContact O-O 3.08Å; D136-K418 WeakPolarHBondContact OD2-CE 3.38Å; D136-K418 IonicContact OD2-NZ 2.84Å; D136-K418 PolarHBondContact OD2-NZ 3.2Å; D136-E420 HydrophobicContact CB-CG 4.11Å; D136-E420 WeakPolarHBondContact CB-OE2 3.41Å
137	L	98.3	Very high	98	Very high	15 Å²	15	53.1 Å²	53.1	8%	0.079	27%	0.267	C	S	.	.			trans	-115.4	6.6	178.5	-57.6	179.3	0	0	0	111.4	A135 T139 N140 F150 Y152 V417	A135-L137 HydrophobicContact CB-CD2 4.17Å; A135-L137 HydrophobicContact CB-CG 4.49Å; L137-T139 PolarHBondContact O-N 2.95Å; L137-N140 HydrophobicContact CB-CB 4.44Å; L137-N140 WeakPolarHBondContact O-CA 3.44Å; L137-N140 WeakPolarHBondContact O-CB 3.48Å; L137-N140 PolarHBondContact O-N 2.94Å; L137-N140 PolarHBondContact O-ND2 3.37Å; L137-F150 HydrophobicContact CD1-CD2 3.84Å; L137-F150 HydrophobicContact CD1-CE2 3.33Å; L137-F150 HydrophobicContact CD1-CZ 4.02Å; L137-Y152 HydrophobicContact CD1-CD2 4Å; L137-Y152 HydrophobicContact CD1-CE2 3.83Å; L137-Y152 HydrophobicContact CD2-CD2 4.13Å; L137-Y152 HydrophobicContact CD2-CE2 4.25Å; L137-V417 HydrophobicContact CD2-CB 3.93Å; L137-V417 HydrophobicContact CD2-CG1 3.76Å
138	D	97.5	Very high	98	Very high	38 Å²	38	50.6 Å²	50.6	20%	0.203	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	48.7	-135.2	-170.5	-58.2	-85.6	0	0	0	110.5	D136 N140 S141 E190 K418	D136-D138 PolarHBondContact OD1-N 3.47Å; D138-N140 PolarHBondContact O-N 2.94Å; D138-N140 VanDerWaalsContact O-N 3.13Å; D138-S141 VanDerWaalsContact O-CB 3.27Å; D138-S141 WeakPolarHBondContact O-CB 3.48Å; D138-S141 PolarHBondContact O-N 2.94Å; D138-S141 VanDerWaalsContact O-N 3.11Å; D138-S141 PolarHBondContact O-OG 2.97Å; D138-E190 VanDerWaalsContact C-CD 3.45Å; D138-E190 WeakPolarHBondContact CA-OE2 3.31Å; D138-E190 VanDerWaalsContact O-CD 3.28Å; D138-E190 WeakPolarHBondContact O-CG 3.27Å; D138-K418 VanDerWaalsContact CG-NZ 3.27Å; D138-K418 IonicContact OD1-NZ 3.62Å; D138-K418 PolarHBondContact OD1-NZ 3.42Å; D138-K418 WeakPolarHBondContact OD2-CE 3.46Å; D138-K418 IonicContact OD2-NZ 2.69Å; D138-K418 PolarHBondContact OD2-NZ 2.95Å; D138-K418 VanDerWaalsContact OD2-NZ 3.13Å
139	T	96.9	Very high	98	Very high	83 Å²	83	48.1 Å²	48.1	51%	0.509	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-63.2	-14.2	174.1	51.4	0	0	0	0	114.5	L137 S141 A142 R187	L137-T139 PolarHBondContact O-N 2.95Å; T139-S141 PolarHBondContact O-N 3.04Å; T139-A142 PolarHBondContact O-N 3.39Å; T139-R187 HydrophobicContact CG2-CG 4.4Å
140	N	97.5	Very high	98	Very high	112 Å²	112	49.1 Å²	49.1	60%	0.599	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-80.8	-3.4	176	-50.9	-55.1	0	0	0	112.7	L137 D138 A142 F150	L137-N140 HydrophobicContact CB-CB 4.44Å; L137-N140 WeakPolarHBondContact O-CA 3.44Å; L137-N140 WeakPolarHBondContact O-CB 3.48Å; L137-N140 PolarHBondContact O-N 2.94Å; L137-N140 PolarHBondContact O-ND2 3.37Å; D138-N140 PolarHBondContact O-N 2.94Å; D138-N140 VanDerWaalsContact O-N 3.13Å; N140-A142 PolarHBondContact O-N 3.23Å; N140-F150 WeakPolarHBondContact O-CZ 3.4Å
141	S	98.2	Very high	98	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.007	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-59.9	-22.9	164.4	58.8	0	0	0	0	112.8	D138 T139 S143 W149 F150 G188	D138-S141 VanDerWaalsContact O-CB 3.27Å; D138-S141 WeakPolarHBondContact O-CB 3.48Å; D138-S141 PolarHBondContact O-N 2.94Å; D138-S141 VanDerWaalsContact O-N 3.11Å; D138-S141 PolarHBondContact O-OG 2.97Å; T139-S141 PolarHBondContact O-N 3.04Å; S141-S143 PolarHBondContact O-N 2.9Å; S141-W149 CarbonylContact O-C 3.42Å; S141-W149 WeakPolarHBondContact O-CA 3.42Å; S141-F150 WeakPolarHBondContact CA-O 3.4Å; S141-F150 WeakPolarHBondContact CB-O 3.49Å; S141-F150 WeakPolarHBondContact O-CD1 3.37Å; S141-F150 VanDerWaalsContact O-CE1 3.32Å; S141-F150 WeakPolarHBondContact O-CE1 3.19Å; S141-F150 PolarHBondContact O-N 2.91Å; S141-G188 WeakPolarHBondContact CB-O 3.33Å; S141-G188 PolarHBondContact OG-O 2.81Å
142	A	98.1	Very high	97.9	Very high	52 Å²	52	50.6 Å²	50.6	43%	0.43	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-68.9	120.8	-179.9	0	0	0	0	0	111.9	T139 N140	T139-A142 PolarHBondContact O-N 3.39Å; N140-A142 PolarHBondContact O-N 3.23Å
143	S	96.9	Very high	97.9	Very high	36 Å²	36	50.9 Å²	50.9	25%	0.252	26%	0.258	S	S	.	.			trans	-81.1	159.5	179	-166.2	0	0	0	0	112.8	S141 K145 T148	S141-S143 PolarHBondContact O-N 2.9Å; S143-K145 PolarHBondContact O-N 3.29Å; S143-K145 PolarHBondContact OG-N 2.95Å; S143-T148 VanDerWaalsContact CB-O 3.24Å; S143-T148 WeakPolarHBondContact CB-O 3.23Å; S143-T148 PolarHBondContact N-O 2.75Å
144	E	95.8	Very high	97.9	Very high	205 Å²	205	53.4 Å²	53.4	96%	0.958	27%	0.267	S	S	*	.	S	Bend	trans	-62.2	-24.8	162.8	-61.1	-173.9	168.6	0	0	112.1	K146	E144-K146 PolarHBondContact O-N 2.87Å
145	K	96.9	Very high	97.9	Very high	106 Å²	106	57.3 Å²	57.3	46%	0.461	28%	0.282	S	S	.	.	S	Bend	trans	-65.6	127.4	171.8	-67.3	170.1	179	168.7	0	109.6	S143 L147 T148 E179	S143-K145 PolarHBondContact O-N 3.29Å; S143-K145 PolarHBondContact OG-N 2.95Å; K145-L147 PolarHBondContact O-N 2.93Å; K145-T148 HydrophobicContact CB-CG2 4.2Å; K145-T148 WeakPolarHBondContact CB-OG1 3.43Å; K145-T148 HydrophobicContact CD-CG2 4.11Å; K145-T148 WeakPolarHBondContact O-CB 3.38Å; K145-T148 PolarHBondContact O-N 2.8Å; K145-T148 PolarHBondContact O-OG1 3.13Å; K145-E179 IonicContact NZ-OE1 3.78Å; K145-E179 PolarHBondContact NZ-OE1 2.9Å; K145-E179 IonicContact NZ-OE2 2.8Å; K145-E179 PolarHBondContact NZ-OE2 2.86Å
146	K	96.9	Very high	97.9	Very high	182 Å²	182	57.3 Å²	57.3	79%	0.791	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	128.7	178.3	178.8	177.8	179.5	-176.2	0	111.6	E144 T148	E144-K146 PolarHBondContact O-N 2.87Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 3.48Å; K146-T148 PolarHBondContact O-OG1 2.92Å; K146-T148 VanDerWaalsContact O-OG1 3.12Å
147	L	97.3	Very high	97.9	Very high	112 Å²	112	59.7 Å²	59.7	59%	0.586	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	48.5	177.2	-59.4	172.7	0	0	0	112.2	K145 W149 H181	K145-L147 PolarHBondContact O-N 2.93Å; L147-W149 HydrophobicContact CB-CH2 4.26Å; L147-W149 HydrophobicContact CB-CZ3 4.2Å; L147-W149 HydrophobicContact CD2-CH2 3.98Å; L147-W149 WeakPolarHBondContact O-CZ3 3.48Å; L147-H181 WeakPolarHBondContact O-CA 3.43Å; L147-H181 WeakPolarHBondContact O-CB 3.33Å; L147-H181 PolarHBondContact O-ND1 2.82Å
148	T	98.6	Very high	97.9	Very high	6 Å²	6	59 Å²	59	4%	0.037	29%	0.287	C	S	.	.			trans	-134.1	130.7	179.2	-51.7	0	0	0	0	108.9	S143 K145 K146 E179 S180 H181	S143-T148 VanDerWaalsContact CB-O 3.24Å; S143-T148 WeakPolarHBondContact CB-O 3.23Å; S143-T148 PolarHBondContact N-O 2.75Å; K145-T148 HydrophobicContact CB-CG2 4.2Å; K145-T148 WeakPolarHBondContact CB-OG1 3.43Å; K145-T148 HydrophobicContact CD-CG2 4.11Å; K145-T148 WeakPolarHBondContact O-CB 3.38Å; K145-T148 PolarHBondContact O-N 2.8Å; K145-T148 PolarHBondContact O-OG1 3.13Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 3.48Å; K146-T148 PolarHBondContact O-OG1 2.92Å; K146-T148 VanDerWaalsContact O-OG1 3.12Å; T148-E179 HydrophobicContact CG2-CB 4.28Å; T148-S180 WeakPolarHBondContact CA-O 3.42Å; T148-H181 PolarHBondContact OG1-CE1 2.85Å; T148-H181 PolarHBondContact OG1-ND1 3.46Å; T148-H181 VanDerWaalsContact OG1-ND1 3.13Å
149	W	98.8	Very high	97.9	Very high	14 Å²	14	58.8 Å²	58.8	5%	0.053	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	153.2	172.6	-61.9	-102.4	0	0	0	109.3	S141 L147 E179 S180 S183 G186 G188 M189	S141-W149 CarbonylContact O-C 3.42Å; S141-W149 WeakPolarHBondContact O-CA 3.42Å; L147-W149 HydrophobicContact CB-CH2 4.26Å; L147-W149 HydrophobicContact CB-CZ3 4.2Å; L147-W149 HydrophobicContact CD2-CH2 3.98Å; L147-W149 WeakPolarHBondContact O-CZ3 3.48Å; W149-E179 WeakPolarHBondContact O-CA 3.28Å; W149-S180 PolarHBondContact N-O 2.98Å; W149-S180 PolarHBondContact O-N 3.04Å; W149-S183 VanDerWaalsContact CH2-CB 3.49Å; W149-S183 WeakPolarHBondContact CH2-OG 3.44Å; W149-S183 WeakPolarHBondContact CZ2-OG 3.32Å; W149-S183 WeakPolarHBondContact CZ3-OG 3.47Å; W149-G186 WeakPolarHBondContact CZ2-O 3.29Å; W149-G186 PolarHBondContact NE1-O 3.03Å; W149-G188 WeakPolarHBondContact CB-O 3.4Å; W149-M189 HydrophobicContact CB-CB 3.91Å; W149-M189 HydrophobicContact CB-CG 3.89Å
150	F	98.8	Very high	98	Very high	31 Å²	31	55.4 Å²	55.4	14%	0.136	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	156.4	-178.4	70.3	-84.2	0	0	0	113.1	L137 N140 S141 Y152 V177 L178 E179	L137-F150 HydrophobicContact CD1-CD2 3.84Å; L137-F150 HydrophobicContact CD1-CE2 3.33Å; L137-F150 HydrophobicContact CD1-CZ 4.02Å; N140-F150 WeakPolarHBondContact O-CZ 3.4Å; S141-F150 WeakPolarHBondContact CA-O 3.4Å; S141-F150 WeakPolarHBondContact CB-O 3.49Å; S141-F150 WeakPolarHBondContact O-CD1 3.37Å; S141-F150 VanDerWaalsContact O-CE1 3.32Å; S141-F150 WeakPolarHBondContact O-CE1 3.19Å; S141-F150 PolarHBondContact O-N 2.91Å; F150-Y152 HydrophobicContact CD2-CD1 4.46Å; F150-Y152 AromaticContact CD2-CE1 3.88Å; F150-Y152 HydrophobicContact CD2-CE1 3.88Å; F150-Y152 AromaticContact CE2-CE1 3.83Å; F150-Y152 HydrophobicContact CE2-CE1 3.83Å; F150-Y152 HydrophobicContact CE2-CE2 4.03Å; F150-Y152 AromaticContact CE2-CZ 3.47Å; F150-Y152 VanDerWaalsContact CE2-CZ 3.47Å; F150-Y152 VanDerWaalsContact CE2-OH 3.31Å; F150-Y152 WeakPolarHBondContact CE2-OH 3.38Å; F150-V177 HydrophobicContact CB-CG1 4.14Å; F150-V177 HydrophobicContact CD2-CG1 4.45Å; F150-L178 CarbonylContact C-O 3.46Å; F150-L178 WeakPolarHBondContact CA-O 3.44Å; F150-L178 WeakPolarHBondContact CB-O 3.43Å; F150-E179 HydrophobicContact CB-CG 4.14Å
151	S	98.8	Very high	98	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	167.5	168.5	170.1	0	0	0	0	109.5	A135 L178	A135-S151 PolarHBondContact O-OG 2.95Å; S151-L178 PolarHBondContact N-O 3.09Å; S151-L178 PolarHBondContact O-N 2.96Å
152	Y	97.8	Very high	97.8	Very high	66 Å²	66	57.9 Å²	57.9	26%	0.259	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.4	171.1	-56.4	-51.7	0	0	0	111	I134 A135 L137 F150 K175 V176 V177	I134-Y152 WeakPolarHBondContact CA-O 3.45Å; A135-Y152 WeakPolarHBondContact CB-O 3.46Å; A135-Y152 PolarHBondContact N-O 2.82Å; L137-Y152 HydrophobicContact CD1-CD2 4Å; L137-Y152 HydrophobicContact CD1-CE2 3.83Å; L137-Y152 HydrophobicContact CD2-CD2 4.13Å; L137-Y152 HydrophobicContact CD2-CE2 4.25Å; F150-Y152 HydrophobicContact CD2-CD1 4.46Å; F150-Y152 AromaticContact CD2-CE1 3.88Å; F150-Y152 HydrophobicContact CD2-CE1 3.88Å; F150-Y152 AromaticContact CE2-CE1 3.83Å; F150-Y152 HydrophobicContact CE2-CE1 3.83Å; F150-Y152 HydrophobicContact CE2-CE2 4.03Å; F150-Y152 AromaticContact CE2-CZ 3.47Å; F150-Y152 VanDerWaalsContact CE2-CZ 3.47Å; F150-Y152 VanDerWaalsContact CE2-OH 3.31Å; F150-Y152 WeakPolarHBondContact CE2-OH 3.38Å; Y152-K175 HydrophobicContact CD2-CD 4.5Å; Y152-K175 HydrophobicContact CG-CD 4.25Å; Y152-V176 CarbonylContact C-O 3.38Å; Y152-V176 WeakPolarHBondContact CA-O 3.14Å; Y152-V177 HydrophobicContact CD1-CG2 4.1Å; Y152-V177 HydrophobicContact CE1-CG1 4.5Å; Y152-V177 HydrophobicContact CE1-CG2 4.04Å
153	M	98.3	Very high	97.4	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.03	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.8	161.3	-174.7	-166.2	-177.5	0	0	109.2	V133 I134 R155 V176 L178 L194 L201 I214 I425	V133-M153 CarbonylContact O-C 3.6Å; V133-M153 WeakPolarHBondContact O-CA 3.25Å; I134-M153 HydrophobicContact CG1-CB 4.36Å; M153-R155 HydrophobicContact CE-CG 4.2Å; M153-V176 HydrophobicContact CB-CB 4.28Å; M153-V176 PolarHBondContact N-O 2.76Å; M153-V176 PolarHBondContact O-N 3.45Å; M153-L178 HydrophobicContact CB-CD1 4.08Å; M153-L194 HydrophobicContact CE-CD2 4.22Å; M153-L201 HydrophobicContact CE-CD2 3.56Å; M153-L201 HydrophobicContact SD-CD2 4.17Å; M153-I214 HydrophobicContact SD-CG2 4.32Å; M153-I425 HydrophobicContact CE-CD1 3.56Å; M153-I425 HydrophobicContact CE-CG2 4.18Å
154	R	98.2	Very high	97.2	Very high	53 Å²	53	59.2 Å²	59.2	20%	0.2	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	135.9	172	-169.4	-174.4	-171	-173.1	0.8	109.1	G132 V133 W171 I414 Y419	G132-R154 CarbonylContact C-O 3.45Å; G132-R154 WeakPolarHBondContact CA-O 3.26Å; V133-R154 HydrophobicContact CG2-CB 3.82Å; V133-R154 PolarHBondContact N-O 2.66Å; V133-R154 PolarHBondContact O-N 3.29Å; R154-W171 HydrophobicContact CG-CE3 3.9Å; R154-W171 HydrophobicContact CG-CZ3 4.42Å; R154-W171 VanDerWaalsContact CZ-CB 3.46Å; R154-I414 PolarHBondContact NH1-O 3.43Å; R154-Y419 HydrophobicContact CB-CE1 4.01Å
155	R	98.5	Very high	97	Very high	81 Å²	81	52.6 Å²	52.6	31%	0.306	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	155.9	178.7	-59.1	177.8	-58.1	-145.6	-7.4	110.8	I131 M153 D172 I425	I131-R155 CarbonylContact O-C 3.54Å; I131-R155 WeakPolarHBondContact O-CA 3.47Å; M153-R155 HydrophobicContact CE-CG 4.2Å; R155-D172 WeakPolarHBondContact CB-OD2 3.25Å; R155-D172 IonicContact NE-OD2 3.89Å; R155-D172 PolarHBondContact NE-OD2 3.19Å; R155-D172 IonicContact NH2-OD2 3.92Å; R155-D172 WeakPolarHBondContact O-CB 3.34Å; R155-D172 PolarHBondContact O-N 3.29Å; R155-I425 HydrophobicContact CG-CD1 3.92Å
156	G	98.5	Very high	97	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	-164.9	179	0	0	0	0	0	112	R130 I131 E170	R130-G156 WeakPolarHBondContact CD-O 3.24Å; R130-G156 PolarHBondContact NH1-O 2.83Å; I131-G156 PolarHBondContact N-O 2.79Å; I131-G156 PolarHBondContact O-N 2.78Å; G156-E170 CarbonylContact C-O 3.57Å; G156-E170 WeakPolarHBondContact CA-O 3.35Å
157	Y	98.8	Very high	97.1	Very high	55 Å²	55	45.7 Å²	45.7	22%	0.216	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.2	168.4	-67.5	-85.7	0	0	0	110.5	R128 Y129 R130 V169 E170	R128-Y157 HydrophobicContact CG-CD1 3.76Å; R128-Y157 HydrophobicContact CG-CG 4.08Å; Y129-Y157 CarbonylContact O-C 3.58Å; Y129-Y157 VanDerWaalsContact O-CA 3.24Å; Y129-Y157 WeakPolarHBondContact O-CA 3.49Å; Y129-Y157 WeakPolarHBondContact O-CD1 3.21Å; R130-Y157 HydrophobicContact CB-CD1 4.46Å; R130-Y157 HydrophobicContact CB-CE1 4.27Å; R130-Y157 VanDerWaalsContact CD-CZ 3.46Å; R130-Y157 HydrophobicContact CG-CE1 4.42Å; R130-Y157 VanDerWaalsContact NH1-CE2 3.26Å; Y157-V169 WeakPolarHBondContact O-CA 3.49Å; Y157-E170 HydrophobicContact CD2-CG 4.37Å; Y157-E170 PolarHBondContact N-O 3.1Å; Y157-E170 PolarHBondContact O-N 3.19Å
158	L	98.7	Very high	97.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	138	163.8	179	148.9	0	0	0	109.2	R128 Y129 I131 V160 V167 A168 V169 I374 L383 F424	R128-L158 CarbonylContact C-O 3.52Å; R128-L158 VanDerWaalsContact CA-O 3.25Å; R128-L158 WeakPolarHBondContact CA-O 3.43Å; Y129-L158 HydrophobicContact CD2-CD2 3.98Å; Y129-L158 PolarHBondContact N-O 3.07Å; Y129-L158 PolarHBondContact O-N 3.14Å; I131-L158 HydrophobicContact CD1-CB 4.45Å; I131-L158 HydrophobicContact CG2-CB 3.94Å; L158-V160 HydrophobicContact CD2-CG2 3.51Å; L158-V167 HydrophobicContact CD1-CG1 3.61Å; L158-V167 HydrophobicContact CD2-CG1 4.21Å; L158-V167 HydrophobicContact CG-CG1 3.77Å; L158-A168 CarbonylContact C-O 3.55Å; L158-A168 WeakPolarHBondContact CA-O 3.47Å; L158-V169 HydrophobicContact CB-CG2 4.49Å; L158-V169 HydrophobicContact CD1-CG2 4.46Å; L158-V169 HydrophobicContact CG-CG2 4.49Å; L158-I374 HydrophobicContact CD1-CD1 3.93Å; L158-I374 HydrophobicContact CD2-CD1 4.22Å; L158-I374 HydrophobicContact CD2-CG2 4.21Å; L158-L383 HydrophobicContact CD1-CB 4.29Å; L158-L383 HydrophobicContact CD1-CD1 3.62Å; L158-L383 HydrophobicContact CD1-CD2 3.54Å; L158-L383 HydrophobicContact CD1-CG 4.01Å; L158-F424 HydrophobicContact CB-CE1 4.44Å; L158-F424 HydrophobicContact CD1-CE1 4.32Å; L158-F424 HydrophobicContact CD1-CZ 4.34Å
159	L	98.6	Very high	97.1	Very high	33 Å²	33	44.2 Å²	44.2	17%	0.173	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	120.3	171.5	176.9	70	0	0	0	109.9	Q125 M127 R128 V167 A168	Q125-L159 HydrophobicContact CB-CD1 4.44Å; Q125-L159 HydrophobicContact CB-CD2 3.95Å; M127-L159 WeakPolarHBondContact O-CA 3.36Å; R128-L159 HydrophobicContact CB-CD1 4.17Å; L159-V167 WeakPolarHBondContact O-CA 3.41Å; L159-A168 PolarHBondContact N-O 3.21Å; L159-A168 PolarHBondContact O-N 2.94Å
160	V	98.3	Very high	97.1	Very high	12 Å²	12	48.4 Å²	48.4	7%	0.073	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.1	166.4	-172.2	0	0	0	0	108.4	G126 M127 Y129 L158 I374	G126-V160 CarbonylContact C-O 3.5Å; G126-V160 VanDerWaalsContact CA-O 3.23Å; G126-V160 WeakPolarHBondContact CA-O 3.35Å; M127-V160 PolarHBondContact N-O 3.29Å; M127-V160 PolarHBondContact O-N 3.06Å; Y129-V160 HydrophobicContact CE2-CG2 4.05Å; L158-V160 HydrophobicContact CD2-CG2 3.51Å; V160-I374 HydrophobicContact CG2-CD1 4.36Å; V160-I374 HydrophobicContact CG2-CG2 3.76Å
161	S	97.3	Very high	97.1	Very high	24 Å²	24	49.7 Å²	49.7	17%	0.168	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	152.4	176.5	64	0	0	0	0	112.5	S163 G164 D165 K166	S161-S163 PolarHBondContact O-N 2.99Å; S161-S163 VanDerWaalsContact O-N 3.1Å; S161-S163 PolarHBondContact OG-OG 3.37Å; S161-G164 PolarHBondContact O-N 3.21Å; S161-G164 PolarHBondContact OG-N 2.93Å; S161-D165 PolarHBondContact OG-N 2.84Å; S161-D165 PolarHBondContact OG-OD1 3Å; S161-K166 PolarHBondContact N-O 2.74Å; S161-K166 PolarHBondContact OG-N 3.25Å; S161-K166 VanDerWaalsContact OG-N 3.15Å; S161-K166 PolarHBondContact OG-O 2.98Å
162	Q	93.5	Very high	97	Very high	141 Å²	141	51.5 Å²	51.5	66%	0.659	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-27.1	172.6	-73.1	-174.5	5.1	0	0	113.6	S124 Q125	S124-Q162 PolarHBondContact O-NE2 3.36Å; Q125-Q162 PolarHBondContact O-N 2.66Å
163	S	91.6	Very high	96.9	Very high	91 Å²	91	53.2 Å²	53.2	64%	0.636	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.1	176.7	32.2	0	0	0	0	114.3	S161 D165	S161-S163 PolarHBondContact O-N 2.99Å; S161-S163 VanDerWaalsContact O-N 3.1Å; S161-S163 PolarHBondContact OG-OG 3.37Å; S163-D165 WeakPolarHBondContact CB-OD1 3.42Å; S163-D165 PolarHBondContact O-N 3.32Å; S163-D165 PolarHBondContact OG-OD1 2.86Å
164	G	91.1	Very high	96.6	Very high	25 Å²	25	59 Å²	59	26%	0.258	32%	0.321	S	S	.	.	S	Bend	trans	64.7	15.4	-177.2	0	0	0	0	0	114.4	S161	S161-G164 PolarHBondContact O-N 3.21Å; S161-G164 PolarHBondContact OG-N 2.93Å
165	D	92.4	Very high	96.4	Very high	66 Å²	66	60.5 Å²	60.5	35%	0.353	33%	0.329	S	S	.	.	S	Bend	trans	-104.4	-10.6	-173	73.5	-34.5	0	0	0	113.6	S161 S163	S161-D165 PolarHBondContact OG-N 2.84Å; S161-D165 PolarHBondContact OG-OD1 3Å; S163-D165 WeakPolarHBondContact CB-OD1 3.42Å; S163-D165 PolarHBondContact O-N 3.32Å; S163-D165 PolarHBondContact OG-OD1 2.86Å
166	K	96.6	Very high	96.4	Very high	134 Å²	134	57.4 Å²	57.4	58%	0.583	32%	0.319	S	S	*	.			trans	-142	143.3	-176.1	-67.9	176.4	-173	176.9	0	111	S161	S161-K166 PolarHBondContact N-O 2.74Å; S161-K166 PolarHBondContact OG-N 3.25Å; S161-K166 VanDerWaalsContact OG-N 3.15Å; S161-K166 PolarHBondContact OG-O 2.98Å
167	V	98.3	Very high	96.3	Very high	9 Å²	9	60.6 Å²	60.6	6%	0.055	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.3	170.8	173.8	0	0	0	0	108.1	L158 L159 I374 A400 L408 L409	L158-V167 HydrophobicContact CD1-CG1 3.61Å; L158-V167 HydrophobicContact CD2-CG1 4.21Å; L158-V167 HydrophobicContact CG-CG1 3.77Å; L159-V167 WeakPolarHBondContact O-CA 3.41Å; V167-I374 HydrophobicContact CG2-CD1 3.99Å; V167-A400 HydrophobicContact CB-CB 3.87Å; V167-A400 HydrophobicContact CG1-CB 3.83Å; V167-A400 HydrophobicContact CG2-CB 3.96Å; V167-L408 HydrophobicContact CB-CB 4.32Å; V167-L408 HydrophobicContact CG2-CB 3.96Å; V167-L408 HydrophobicContact CG2-CD1 4.14Å; V167-L408 PolarHBondContact N-O 2.89Å; V167-L408 VanDerWaalsContact N-O 3.15Å; V167-L409 HydrophobicContact CB-CB 4.03Å; V167-L409 HydrophobicContact CG1-CB 4.28Å; V167-L409 HydrophobicContact CG1-CD2 4.26Å
168	A	98.3	Very high	96.3	Very high	51 Å²	51	58 Å²	58	42%	0.421	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.5	172.3	0	0	0	0	0	109.8	L158 L159	L158-A168 CarbonylContact C-O 3.55Å; L158-A168 WeakPolarHBondContact CA-O 3.47Å; L159-A168 PolarHBondContact N-O 3.21Å; L159-A168 PolarHBondContact O-N 2.94Å
169	V	98.5	Very high	96.3	Very high	37 Å²	37	61.5 Å²	61.5	22%	0.224	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	130.9	177.2	176.1	0	0	0	0	109.5	I131 Y157 L158 W171 I398 L409	I131-V169 HydrophobicContact CD1-CG1 3.81Å; I131-V169 HydrophobicContact CD1-CG2 4.47Å; Y157-V169 WeakPolarHBondContact O-CA 3.49Å; L158-V169 HydrophobicContact CB-CG2 4.49Å; L158-V169 HydrophobicContact CD1-CG2 4.46Å; L158-V169 HydrophobicContact CG-CG2 4.49Å; V169-W171 HydrophobicContact CG1-CD2 4.21Å; V169-W171 HydrophobicContact CG1-CH2 4.33Å; V169-W171 HydrophobicContact CG1-CZ2 3.66Å; V169-I398 HydrophobicContact CG1-CD1 4.49Å; V169-I398 HydrophobicContact CG2-CD1 4.21Å; V169-L409 HydrophobicContact CG2-CD2 3.82Å
170	E	98	Very high	96.3	Very high	102 Å²	102	60.5 Å²	60.5	48%	0.477	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	150.9	169.6	61.2	-177.3	177	0	0	109.4	R128 G156 Y157	R128-E170 IonicContact NH1-OE1 2.65Å; R128-E170 PolarHBondContact NH1-OE1 3Å; G156-E170 CarbonylContact C-O 3.57Å; G156-E170 WeakPolarHBondContact CA-O 3.35Å; Y157-E170 HydrophobicContact CD2-CG 4.37Å; Y157-E170 PolarHBondContact N-O 3.1Å; Y157-E170 PolarHBondContact O-N 3.19Å
171	W	98.4	Very high	96.3	Very high	58 Å²	58	66 Å²	66	22%	0.22	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.7	-175	-64.9	106.1	0	0	0	111.5	I131 V133 R154 V169 I398 I414	I131-W171 HydrophobicContact CD1-CH2 3.82Å; I131-W171 HydrophobicContact CD1-CZ2 4.43Å; I131-W171 HydrophobicContact CD1-CZ3 4.06Å; I131-W171 HydrophobicContact CG1-CZ3 4.35Å; V133-W171 HydrophobicContact CB-CH2 4.42Å; V133-W171 HydrophobicContact CG1-CH2 3.71Å; V133-W171 HydrophobicContact CG1-CZ3 4.24Å; V133-W171 HydrophobicContact CG2-CH2 3.78Å; V133-W171 HydrophobicContact CG2-CZ3 3.75Å; R154-W171 HydrophobicContact CG-CE3 3.9Å; R154-W171 HydrophobicContact CG-CZ3 4.42Å; R154-W171 VanDerWaalsContact CZ-CB 3.46Å; V169-W171 HydrophobicContact CG1-CD2 4.21Å; V169-W171 HydrophobicContact CG1-CH2 4.33Å; V169-W171 HydrophobicContact CG1-CZ2 3.66Å; W171-I398 HydrophobicContact CH2-CD1 4.23Å; W171-I398 HydrophobicContact CZ2-CD1 3.92Å; W171-I414 HydrophobicContact CH2-CD1 4.3Å; W171-I414 HydrophobicContact CZ2-CB 4.21Å; W171-I414 HydrophobicContact CZ2-CD1 3.95Å; W171-I414 HydrophobicContact CZ2-CG2 3.85Å
172	D	98.1	Very high	96.4	Very high	37 Å²	37	68.6 Å²	68.6	20%	0.198	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	152.3	166.9	-65.9	11.3	0	0	0	110	R130 R155	R130-D172 IonicContact CZ-OD1 3Å; R130-D172 IonicContact CZ-OD2 3.2Å; R130-D172 IonicContact NH1-OD1 3.49Å; R130-D172 PolarHBondContact NH1-OD1 2.91Å; R130-D172 IonicContact NH1-OD2 3Å; R130-D172 IonicContact NH2-OD1 3.34Å; R130-D172 PolarHBondContact NH2-OD1 3.1Å; R130-D172 IonicContact NH2-OD2 2.93Å; R130-D172 PolarHBondContact NH2-OD2 3.29Å; R155-D172 WeakPolarHBondContact CB-OD2 3.25Å; R155-D172 IonicContact NE-OD2 3.89Å; R155-D172 PolarHBondContact NE-OD2 3.19Å; R155-D172 IonicContact NH2-OD2 3.92Å; R155-D172 WeakPolarHBondContact O-CB 3.34Å; R155-D172 PolarHBondContact O-N 3.29Å
173	A	94.5	Very high	96.6	Very high	103 Å²	103	64 Å²	64	85%	0.851	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	-40.9	173.1	0	0	0	0	0	112.1
174	D	91.9	Very high	97	Very high	126 Å²	126	62 Å²	62	67%	0.674	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.8	-174.7	-61.1	-41.7	0	0	0	112.3
175	K	95.1	Very high	97.3	Very high	86 Å²	86	69.1 Å²	69.1	37%	0.374	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142.2	165.9	-61	-179.6	-176.7	-178.8	0	109.3	Y152	Y152-K175 HydrophobicContact CD2-CD 4.5Å; Y152-K175 HydrophobicContact CG-CD 4.25Å
176	V	97.4	Very high	97.5	Very high	16 Å²	16	68 Å²	68	10%	0.097	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.5	167.3	-179.3	0	0	0	0	108.1	Y152 M153 L178 R216 D217	Y152-V176 CarbonylContact C-O 3.38Å; Y152-V176 WeakPolarHBondContact CA-O 3.14Å; M153-V176 HydrophobicContact CB-CB 4.28Å; M153-V176 PolarHBondContact N-O 2.76Å; M153-V176 PolarHBondContact O-N 3.45Å; V176-L178 HydrophobicContact CG1-CD2 4.16Å; V176-R216 WeakPolarHBondContact CG1-O 3.38Å; V176-D217 HydrophobicContact CG1-CB 4.15Å
177	V	98.3	Very high	97.6	Very high	67 Å²	67	65.1 Å²	65.1	41%	0.406	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129	172.3	-172.9	0	0	0	0	108.3	F150 Y152 E179	F150-V177 HydrophobicContact CB-CG1 4.14Å; F150-V177 HydrophobicContact CD2-CG1 4.45Å; Y152-V177 HydrophobicContact CD1-CG2 4.1Å; Y152-V177 HydrophobicContact CE1-CG1 4.5Å; Y152-V177 HydrophobicContact CE1-CG2 4.04Å; V177-E179 HydrophobicContact CG1-CG 4.09Å
178	L	98.6	Very high	97.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	119.8	176.7	-61.7	170.4	0	0	0	107.7	I134 F150 S151 M153 V176 M189 L191 I214	I134-L178 HydrophobicContact CD1-CD1 3.67Å; I134-L178 HydrophobicContact CG1-CD1 4.36Å; F150-L178 CarbonylContact C-O 3.46Å; F150-L178 WeakPolarHBondContact CA-O 3.44Å; F150-L178 WeakPolarHBondContact CB-O 3.43Å; S151-L178 PolarHBondContact N-O 3.09Å; S151-L178 PolarHBondContact O-N 2.96Å; M153-L178 HydrophobicContact CB-CD1 4.08Å; V176-L178 HydrophobicContact CG1-CD2 4.16Å; L178-M189 HydrophobicContact CB-CE 3.83Å; L178-M189 WeakPolarHBondContact O-CE 3.39Å; L178-L191 HydrophobicContact CD1-CD1 4.41Å; L178-I214 HydrophobicContact CD1-CD1 4.09Å; L178-I214 HydrophobicContact CD1-CG2 4.09Å; L178-I214 HydrophobicContact CD2-CG2 4.02Å
179	E	98.5	Very high	97.6	Very high	73 Å²	73	62.2 Å²	62.2	34%	0.341	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	146.6	-179.1	-57.7	-165.5	144.9	0	0	112	K145 T148 W149 F150 V177	K145-E179 IonicContact NZ-OE1 3.78Å; K145-E179 PolarHBondContact NZ-OE1 2.9Å; K145-E179 IonicContact NZ-OE2 2.8Å; K145-E179 PolarHBondContact NZ-OE2 2.86Å; T148-E179 HydrophobicContact CG2-CB 4.28Å; W149-E179 WeakPolarHBondContact O-CA 3.28Å; F150-E179 HydrophobicContact CB-CG 4.14Å; V177-E179 HydrophobicContact CG1-CG 4.09Å
180	S	98.6	Very high	97.7	Very high	12 Å²	12	60.5 Å²	60.5	8%	0.084	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	156.9	168.8	-176.5	0	0	0	0	111.2	T148 W149 L182 M189 Y212	T148-S180 WeakPolarHBondContact CA-O 3.42Å; W149-S180 PolarHBondContact N-O 2.98Å; W149-S180 PolarHBondContact O-N 3.04Å; S180-L182 PolarHBondContact OG-N 3.24Å; S180-M189 WeakPolarHBondContact CB-SD 3.38Å; S180-Y212 PolarHBondContact OG-OH 2.9Å
181	H	98.4	Very high	97.7	Very high	128 Å²	128	55.6 Å²	55.6	59%	0.593	30%	0.298	S	S	*	.			trans	-107.2	2.5	173.5	-56.7	-58.2	0	0	0	112.7	L147 T148	L147-H181 WeakPolarHBondContact O-CA 3.43Å; L147-H181 WeakPolarHBondContact O-CB 3.33Å; L147-H181 PolarHBondContact O-ND1 2.82Å; T148-H181 PolarHBondContact OG1-CE1 2.85Å; T148-H181 PolarHBondContact OG1-ND1 3.46Å; T148-H181 VanDerWaalsContact OG1-ND1 3.13Å
182	L	98.6	Very high	97.7	Very high	78 Å²	78	53 Å²	53	41%	0.408	29%	0.289	S	S	.	.			trans	-88.1	139.6	175.3	-55.8	-179.7	0	0	0	109.8	S180 I210 P221	S180-L182 PolarHBondContact OG-N 3.24Å; L182-I210 HydrophobicContact CB-CD1 4.25Å; L182-I210 HydrophobicContact CD1-CD1 3.72Å; L182-P221 HydrophobicContact CD1-CB 4.32Å; L182-P221 HydrophobicContact CD1-CG 3.61Å
183	S	98.4	Very high	97.7	Very high	46 Å²	46	51.2 Å²	51.2	32%	0.322	28%	0.279	S	S	.	.			trans	-155.5	155.1	176.9	57.2	0	0	0	0	110.9	W149 R187	W149-S183 VanDerWaalsContact CH2-CB 3.49Å; W149-S183 WeakPolarHBondContact CH2-OG 3.44Å; W149-S183 WeakPolarHBondContact CZ2-OG 3.32Å; W149-S183 WeakPolarHBondContact CZ3-OG 3.47Å; S183-R187 CarbonylContact C-O 3.58Å; S183-R187 WeakPolarHBondContact CA-O 3.46Å; S183-R187 WeakPolarHBondContact CB-O 3.29Å
184	E	98.4	Very high	98	Very high	47 Å²	47	46.3 Å²	46.3	22%	0.22	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-110.6	128.4	163.1	-170.8	-177	123.6	0	0	108.3	G186 R187 T208 K234 G235	E184-G186 PolarHBondContact O-N 3.45Å; E184-R187 PolarHBondContact N-O 2.93Å; E184-R187 PolarHBondContact O-N 2.99Å; E184-T208 HydrophobicContact CB-CG2 4.22Å; E184-K234 WeakPolarHBondContact OE1-CB 3.41Å; E184-K234 WeakPolarHBondContact OE2-CA 3.28Å; E184-G235 PolarHBondContact OE2-N 2.92Å
185	K	97.4	Very high	98.3	Very high	176 Å²	176	40.5 Å²	40.5	77%	0.765	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	27.8	179.5	-63.8	157.8	-176.1	141.3	0	114
186	G	97.5	Very high	98.5	Very high	43 Å²	43	36.9 Å²	36.9	44%	0.443	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	14.9	179.6	0	0	0	0	0	115.3	W149 E184	W149-G186 WeakPolarHBondContact CZ2-O 3.29Å; W149-G186 PolarHBondContact NE1-O 3.03Å; E184-G186 PolarHBondContact O-N 3.45Å
187	R	98.6	Very high	98.5	Very high	72 Å²	72	36.1 Å²	36.1	27%	0.272	19%	0.188	S	C	.	.	B	Isolated β-bridge	trans	-123.9	145.9	175.5	-82	-178.5	73.7	167.4	1.7	110.3	T139 S183 E184 E190 R207	T139-R187 HydrophobicContact CG2-CG 4.4Å; S183-R187 CarbonylContact C-O 3.58Å; S183-R187 WeakPolarHBondContact CA-O 3.46Å; S183-R187 WeakPolarHBondContact CB-O 3.29Å; E184-R187 PolarHBondContact N-O 2.93Å; E184-R187 PolarHBondContact O-N 2.99Å; R187-E190 WeakPolarHBondContact CB-OE1 3.14Å; R187-E190 VanDerWaalsContact CG-OE1 3.3Å; R187-E190 WeakPolarHBondContact CG-OE1 3.29Å; R187-E190 IonicContact CZ-OE1 3.38Å; R187-E190 IonicContact CZ-OE2 3.78Å; R187-E190 VanDerWaalsContact CZ-OE2 3.27Å; R187-E190 IonicContact NE-OE1 2.95Å; R187-E190 PolarHBondContact NE-OE1 3.49Å; R187-E190 IonicContact NE-OE2 2.63Å; R187-E190 PolarHBondContact NE-OE2 3.05Å; R187-E190 IonicContact NH2-OE1 3.25Å; R187-E190 IonicContact NH2-OE2 3.81Å; R187-E190 PolarHBondContact NH2-OE2 2.97Å; R187-R207 HydrophobicContact CB-CB 4.15Å; R187-R207 HydrophobicContact CB-CG 3.89Å; R187-R207 VanDerWaalsContact CZ-CZ 3.5Å
188	G	98.6	Very high	98.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.			trans	172.6	167.8	-177.7	0	0	0	0	0	111.7	S141 W149 E190 D205	S141-G188 WeakPolarHBondContact CB-O 3.33Å; S141-G188 PolarHBondContact OG-O 2.81Å; W149-G188 WeakPolarHBondContact CB-O 3.4Å; G188-E190 PolarHBondContact O-N 2.8Å; G188-D205 WeakPolarHBondContact CA-OD2 3.35Å
189	M	98.8	Very high	98.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.			trans	56.8	28.5	-168.6	-60	-61.3	-69.9	0	0	114.1	W149 L178 S180 L191 D205 Y212 A219	W149-M189 HydrophobicContact CB-CB 3.91Å; W149-M189 HydrophobicContact CB-CG 3.89Å; L178-M189 HydrophobicContact CB-CE 3.83Å; L178-M189 WeakPolarHBondContact O-CE 3.39Å; S180-M189 WeakPolarHBondContact CB-SD 3.38Å; M189-L191 HydrophobicContact CE-CD1 3.9Å; M189-L191 HydrophobicContact CE-CG 4.47Å; M189-L191 PolarHBondContact O-N 3.45Å; M189-D205 PolarHBondContact N-OD2 3.24Å; M189-D205 VanDerWaalsContact N-OD2 3.08Å; M189-Y212 HydrophobicContact SD-CE1 4.35Å; M189-Y212 HydrophobicContact SD-CE2 4.08Å; M189-A219 HydrophobicContact CE-CB 3.75Å; M189-A219 HydrophobicContact SD-CB 4.34Å
190	E	98.8	Very high	98.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.			trans	-91.7	89.5	172	-62.4	-179.6	-133.8	0	0	106	D136 D138 R187 G188 D205 D206 R207	D136-E190 WeakPolarHBondContact OD1-CA 3.34Å; D136-E190 WeakPolarHBondContact OD1-CB 3.4Å; D136-E190 WeakPolarHBondContact OD1-CG 3.44Å; D138-E190 VanDerWaalsContact C-CD 3.45Å; D138-E190 WeakPolarHBondContact CA-OE2 3.31Å; D138-E190 VanDerWaalsContact O-CD 3.28Å; D138-E190 WeakPolarHBondContact O-CG 3.27Å; R187-E190 WeakPolarHBondContact CB-OE1 3.14Å; R187-E190 VanDerWaalsContact CG-OE1 3.3Å; R187-E190 WeakPolarHBondContact CG-OE1 3.29Å; R187-E190 IonicContact CZ-OE1 3.38Å; R187-E190 IonicContact CZ-OE2 3.78Å; R187-E190 VanDerWaalsContact CZ-OE2 3.27Å; R187-E190 IonicContact NE-OE1 2.95Å; R187-E190 PolarHBondContact NE-OE1 3.49Å; R187-E190 IonicContact NE-OE2 2.63Å; R187-E190 PolarHBondContact NE-OE2 3.05Å; R187-E190 IonicContact NH2-OE1 3.25Å; R187-E190 IonicContact NH2-OE2 3.81Å; R187-E190 PolarHBondContact NH2-OE2 2.97Å; G188-E190 PolarHBondContact O-N 2.8Å; E190-D205 WeakPolarHBondContact O-CA 3.33Å; E190-D206 VanDerWaalsContact CB-OD1 3.27Å; E190-D206 WeakPolarHBondContact CB-OD1 3.41Å; E190-D206 PolarHBondContact O-N 2.74Å; E190-R207 HydrophobicContact CB-CG 3.81Å; E190-R207 VanDerWaalsContact CD-CG 3.49Å; E190-R207 HydrophobicContact CG-CG 3.91Å; E190-R207 WeakPolarHBondContact OE1-CG 3.32Å; E190-R207 WeakPolarHBondContact OE2-CD 3.37Å
191	L	98.9	Very high	98.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	99.1	-159.5	-66.9	-170.2	0	0	0	112.3	I134 L178 M189 V204 D205 Y212	I134-L191 HydrophobicContact CD1-CB 4.43Å; I134-L191 HydrophobicContact CD1-CD1 3.5Å; I134-L191 HydrophobicContact CG1-CB 4.23Å; I134-L191 HydrophobicContact CG1-CD1 3.91Å; I134-L191 HydrophobicContact CG2-CB 4.35Å; L178-L191 HydrophobicContact CD1-CD1 4.41Å; M189-L191 HydrophobicContact CE-CD1 3.9Å; M189-L191 HydrophobicContact CE-CG 4.47Å; M189-L191 PolarHBondContact O-N 3.45Å; L191-V204 WeakPolarHBondContact CA-O 3.47Å; L191-D205 HydrophobicContact CD2-CB 3.98Å; L191-Y212 HydrophobicContact CD2-CD2 4.46Å
192	S	98.6	Very high	98.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	5.9	-163.1	-61.9	0	0	0	0	117	V204 E420	S192-V204 PolarHBondContact N-O 2.92Å; S192-V204 VanDerWaalsContact N-O 3.16Å; S192-E420 CarbonylContact C-O 3.58Å; S192-E420 PolarHBondContact OG-OE2 3.3Å
193	D	98.9	Very high	98.6	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	173.9	157.7	-153.2	-12.5	0	0	0	110.9	S203 W240 L241 S370 K372 E420 G421	D193-S203 WeakPolarHBondContact O-CA 3.28Å; D193-S203 VanDerWaalsContact O-CB 3.32Å; D193-S203 WeakPolarHBondContact O-CB 3.48Å; D193-S203 PolarHBondContact O-OG 2.99Å; D193-W240 WeakPolarHBondContact OD2-CA 3.21Å; D193-L241 HydrophobicContact CB-CB 4.06Å; D193-L241 HydrophobicContact CB-CD1 4.01Å; D193-L241 HydrophobicContact CB-CG 3.84Å; D193-L241 PolarHBondContact OD2-N 3.23Å; D193-S370 PolarHBondContact OD1-OG 2.89Å; D193-K372 IonicContact OD1-NZ 2.87Å; D193-K372 PolarHBondContact OD1-NZ 2.61Å; D193-E420 WeakPolarHBondContact CA-O 3.39Å; D193-G421 WeakPolarHBondContact OD1-CA 3.43Å
194	L	98.9	Very high	98.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.8	177.8	-168.7	69.5	0	0	0	109.6	I134 M153 L201 Y202 K372 E423	I134-L194 HydrophobicContact CB-CD1 4.31Å; I134-L194 HydrophobicContact CD1-CD1 4Å; I134-L194 HydrophobicContact CG2-CB 3.96Å; I134-L194 HydrophobicContact CG2-CD1 4.33Å; M153-L194 HydrophobicContact CE-CD2 4.22Å; L194-L201 HydrophobicContact CD1-CD1 3.82Å; L194-L201 HydrophobicContact CD1-CD2 4.2Å; L194-L201 HydrophobicContact CD1-CG 3.92Å; L194-L201 HydrophobicContact CD2-CD1 4.3Å; L194-L201 HydrophobicContact CG-CD1 3.86Å; L194-Y202 WeakPolarHBondContact CA-O 3.16Å; L194-K372 VanDerWaalsContact O-CE 3.31Å; L194-K372 WeakPolarHBondContact O-CE 3.31Å; L194-K372 PolarHBondContact O-NZ 2.8Å; L194-E423 HydrophobicContact CB-CB 4.23Å; L194-E423 HydrophobicContact CD2-CB 3.82Å; L194-E423 HydrophobicContact CG-CB 3.82Å
195	V	98.9	Very high	98.7	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.024	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	146.2	-176.7	74.8	0	0	0	0	112.6	Y202 L241 V243 L248 E423	V195-Y202 PolarHBondContact N-O 2.87Å; V195-Y202 PolarHBondContact O-N 3.42Å; V195-L241 HydrophobicContact CB-CB 3.84Å; V195-L241 HydrophobicContact CB-CD1 4.22Å; V195-L241 HydrophobicContact CG1-CB 3.92Å; V195-L241 HydrophobicContact CG1-CD1 3.74Å; V195-L241 HydrophobicContact CG1-CG 4.37Å; V195-L241 HydrophobicContact CG2-CB 4.39Å; V195-V243 HydrophobicContact CG2-CG2 3.83Å; V195-L248 HydrophobicContact CG1-CD1 3.76Å; V195-L248 HydrophobicContact CG2-CD1 4.34Å; V195-E423 VanDerWaalsContact CA-OE2 3.29Å; V195-E423 WeakPolarHBondContact CA-OE2 3.11Å
196	V	98.9	Very high	98.7	Very high	9 Å²	9	13 Å²	13	6%	0.055	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.5	164.1	169.6	0	0	0	0	109.7	Y115 L117 K200 L201 E423	Y115-V196 HydrophobicContact CD2-CB 3.73Å; Y115-V196 HydrophobicContact CD2-CG1 3.79Å; Y115-V196 HydrophobicContact CD2-CG2 4.41Å; Y115-V196 HydrophobicContact CE2-CB 3.91Å; Y115-V196 HydrophobicContact CE2-CG1 4.47Å; Y115-V196 HydrophobicContact CE2-CG2 4.39Å; L117-V196 HydrophobicContact CD1-CG2 3.79Å; L117-V196 HydrophobicContact CD2-CG1 3.65Å; L117-V196 HydrophobicContact CD2-CG2 4.29Å; L117-V196 HydrophobicContact CG-CB 4.49Å; L117-V196 HydrophobicContact CG-CG1 3.92Å; L117-V196 HydrophobicContact CG-CG2 3.64Å; V196-K200 WeakPolarHBondContact CA-O 3.5Å; V196-L201 HydrophobicContact CG2-CD1 3.96Å; V196-E423 HydrophobicContact CB-CG 4.24Å; V196-E423 HydrophobicContact CG2-CG 3.66Å; V196-E423 PolarHBondContact N-OE2 3.32Å
197	F	98.9	Very high	98.8	Very high	1 Å²	1	13.9 Å²	13.9	0%	0.004	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	138.1	179.1	179.2	-121.7	0	0	0	109.9	Y111 G199 K200 Y202 W222 V243 E246 L248 F277	Y111-F197 AromaticContact CE2-CD2 3.8Å; Y111-F197 HydrophobicContact CE2-CD2 3.8Å; Y111-F197 AromaticContact CE2-CE2 3.5Å; Y111-F197 HydrophobicContact CE2-CE2 3.5Å; Y111-F197 HydrophobicContact CE2-CZ 4.13Å; Y111-F197 WeakPolarHBondContact OH-CD2 3.39Å; F197-G199 PolarHBondContact O-N 2.79Å; F197-K200 PolarHBondContact N-O 3.24Å; F197-K200 PolarHBondContact O-N 2.73Å; F197-K200 VanDerWaalsContact O-O 3.1Å; F197-Y202 HydrophobicContact CB-CD2 3.95Å; F197-Y202 HydrophobicContact CB-CE2 4.24Å; F197-Y202 HydrophobicContact CD1-CE2 4.26Å; F197-Y202 WeakPolarHBondContact O-CE2 3.43Å; F197-W222 HydrophobicContact CD1-CH2 4.22Å; F197-W222 HydrophobicContact CD1-CZ3 4.37Å; F197-W222 AromaticContact CE1-CH2 3.9Å; F197-W222 HydrophobicContact CE1-CH2 3.9Å; F197-W222 HydrophobicContact CE1-CZ3 4.41Å; F197-V243 HydrophobicContact CB-CG2 4.01Å; F197-V243 HydrophobicContact CD2-CB 4.38Å; F197-V243 HydrophobicContact CD2-CG1 3.77Å; F197-V243 HydrophobicContact CD2-CG2 3.64Å; F197-V243 HydrophobicContact CE2-CG1 4.08Å; F197-V243 HydrophobicContact CG-CG2 4.2Å; F197-E246 WeakPolarHBondContact CE2-O 3.38Å; F197-E246 VanDerWaalsContact CZ-O 3.29Å; F197-E246 WeakPolarHBondContact CZ-O 3.4Å; F197-L248 HydrophobicContact CD1-CB 3.76Å; F197-L248 HydrophobicContact CD1-CD2 4.23Å; F197-L248 HydrophobicContact CD2-CB 4.18Å; F197-L248 HydrophobicContact CE1-CB 3.68Å; F197-L248 HydrophobicContact CE2-CB 4.13Å; F197-L248 HydrophobicContact CG-CB 4Å; F197-L248 HydrophobicContact CZ-CB 3.89Å; F197-F277 HydrophobicContact CE1-CB 4.12Å; F197-F277 HydrophobicContact CZ-CB 3.82Å
198	N	98.6	Very high	98.8	Very high	18 Å²	18	10.8 Å²	10.8	10%	0.096	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	43.5	-179.3	-165.5	17	0	0	0	113.3	Y111 N112 K200 F277	Y111-N198 HydrophobicContact CD2-CB 4.04Å; Y111-N198 HydrophobicContact CE2-CB 3.73Å; Y111-N198 PolarHBondContact OH-N 2.88Å; N112-N198 WeakPolarHBondContact CB-OD1 3.26Å; N112-N198 PolarHBondContact N-OD1 2.98Å; N112-N198 CarbonylContact O-C 3.52Å; N112-N198 VanDerWaalsContact O-CA 3.29Å; N112-N198 WeakPolarHBondContact O-CA 3.48Å; N198-K200 PolarHBondContact O-N 3.21Å; N198-F277 HydrophobicContact CB-CB 4.11Å; N198-F277 PolarHBondContact ND2-O 3.45Å
199	G	98.3	Very high	98.8	Very high	20 Å²	20	10.8 Å²	10.8	21%	0.206	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	26.9	-177.3	0	0	0	0	0	115.6	N112 L117 F197	N112-G199 PolarHBondContact O-N 2.83Å; L117-G199 WeakPolarHBondContact CD2-O 3.32Å; F197-G199 PolarHBondContact O-N 2.79Å
200	K	98.7	Very high	98.8	Very high	82 Å²	82	11.5 Å²	11.5	36%	0.357	6%	0.058	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.7	-178	-70.8	169.8	-168	163.1	0	110.7	V196 F197 N198 Y202	V196-K200 WeakPolarHBondContact CA-O 3.5Å; F197-K200 PolarHBondContact N-O 3.24Å; F197-K200 PolarHBondContact O-N 2.73Å; F197-K200 VanDerWaalsContact O-O 3.1Å; N198-K200 PolarHBondContact O-N 3.21Å; K200-Y202 HydrophobicContact CB-CD2 4.16Å; K200-Y202 HydrophobicContact CB-CE2 3.54Å; K200-Y202 HydrophobicContact CD-CE2 4.34Å
201	L	98.9	Very high	98.8	Very high	13 Å²	13	11.5 Å²	11.5	7%	0.068	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	130.2	176.7	-171.4	64	0	0	0	110.3	L117 M153 L194 V196 H213 I214 E423 I425	L117-L201 HydrophobicContact CD1-CB 3.94Å; M153-L201 HydrophobicContact CE-CD2 3.56Å; M153-L201 HydrophobicContact SD-CD2 4.17Å; L194-L201 HydrophobicContact CD1-CD1 3.82Å; L194-L201 HydrophobicContact CD1-CD2 4.2Å; L194-L201 HydrophobicContact CD1-CG 3.92Å; L194-L201 HydrophobicContact CD2-CD1 4.3Å; L194-L201 HydrophobicContact CG-CD1 3.86Å; V196-L201 HydrophobicContact CG2-CD1 3.96Å; L201-H213 PolarHBondContact O-CD2 3.42Å; L201-I214 HydrophobicContact CB-CB 4.36Å; L201-I214 HydrophobicContact CD2-CB 4.11Å; L201-I214 HydrophobicContact CD2-CG2 4.19Å; L201-I214 HydrophobicContact CG-CB 4.18Å; L201-I214 PolarHBondContact O-N 2.97Å; L201-E423 HydrophobicContact CD1-CB 4.46Å; L201-E423 HydrophobicContact CD1-CG 4.24Å; L201-I425 HydrophobicContact CD1-CG2 3.71Å; L201-I425 HydrophobicContact CD2-CG2 4.02Å
202	Y	98.9	Very high	98.8	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.008	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.9	-178.6	-70.6	-81.7	0	0	0	112.1	L194 V195 F197 K200 I211 Y212 H213 W222	L194-Y202 WeakPolarHBondContact CA-O 3.16Å; V195-Y202 PolarHBondContact N-O 2.87Å; V195-Y202 PolarHBondContact O-N 3.42Å; F197-Y202 HydrophobicContact CB-CD2 3.95Å; F197-Y202 HydrophobicContact CB-CE2 4.24Å; F197-Y202 HydrophobicContact CD1-CE2 4.26Å; F197-Y202 WeakPolarHBondContact O-CE2 3.43Å; K200-Y202 HydrophobicContact CB-CD2 4.16Å; K200-Y202 HydrophobicContact CB-CE2 3.54Å; K200-Y202 HydrophobicContact CD-CE2 4.34Å; Y202-I211 HydrophobicContact CD1-CG2 3.76Å; Y202-I211 HydrophobicContact CG-CG2 4.3Å; Y202-Y212 VanDerWaalsContact CA-O 3.32Å; Y202-Y212 WeakPolarHBondContact CA-O 3.24Å; Y202-H213 HydrophobicContact CD1-CB 4.06Å; Y202-H213 HydrophobicContact CE1-CB 3.69Å; Y202-W222 AromaticContact CD1-CE3 3.85Å; Y202-W222 HydrophobicContact CD1-CE3 3.85Å; Y202-W222 HydrophobicContact CD1-CZ3 4.46Å; Y202-W222 HydrophobicContact CE1-CB 4.09Å; Y202-W222 AromaticContact CE1-CD2 3.58Å; Y202-W222 HydrophobicContact CE1-CD2 3.58Å; Y202-W222 AromaticContact CE1-CE3 3.25Å; Y202-W222 HydrophobicContact CE1-CE3 3.25Å; Y202-W222 AromaticContact CE1-CG 3.94Å; Y202-W222 HydrophobicContact CE1-CG 3.94Å; Y202-W222 AromaticContact CE1-CZ3 3.97Å; Y202-W222 HydrophobicContact CE1-CZ3 3.97Å; Y202-W222 AromaticContact CZ-CD2 3.94Å; Y202-W222 AromaticContact CZ-CE3 3.7Å
203	S	98.9	Very high	98.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	167.6	168.6	-173.6	0	0	0	0	109.3	D193 I211 Y212	D193-S203 WeakPolarHBondContact O-CA 3.28Å; D193-S203 VanDerWaalsContact O-CB 3.32Å; D193-S203 WeakPolarHBondContact O-CB 3.48Å; D193-S203 PolarHBondContact O-OG 2.99Å; S203-I211 CarbonylContact O-C 3.53Å; S203-I211 WeakPolarHBondContact O-CA 3.37Å; S203-Y212 PolarHBondContact N-O 2.96Å; S203-Y212 PolarHBondContact O-N 3.44Å
204	V	98.9	Very high	98.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.1	-176.1	66.7	0	0	0	0	110.9	L191 S192 I210 I211 A238 L241	L191-V204 WeakPolarHBondContact CA-O 3.47Å; S192-V204 PolarHBondContact N-O 2.92Å; S192-V204 VanDerWaalsContact N-O 3.16Å; V204-I210 WeakPolarHBondContact CA-O 3.36Å; V204-I211 HydrophobicContact CG2-CG1 4.1Å; V204-A238 HydrophobicContact CB-CB 4.25Å; V204-A238 HydrophobicContact CG1-CB 3.63Å; V204-A238 HydrophobicContact CG2-CB 3.56Å; V204-L241 HydrophobicContact CB-CD1 4.35Å; V204-L241 HydrophobicContact CB-CD2 4.34Å; V204-L241 HydrophobicContact CG1-CD1 3.99Å; V204-L241 HydrophobicContact CG1-CD2 3.97Å; V204-L241 HydrophobicContact CG1-CG 4.03Å
205	D	98.9	Very high	98.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114.7	176.5	170.8	-0.5	0	0	0	109.8	G188 M189 E190 L191 R207 T208 G209 I210 Y212	G188-D205 WeakPolarHBondContact CA-OD2 3.35Å; M189-D205 PolarHBondContact N-OD2 3.24Å; M189-D205 VanDerWaalsContact N-OD2 3.08Å; E190-D205 WeakPolarHBondContact O-CA 3.33Å; L191-D205 HydrophobicContact CD2-CB 3.98Å; D205-R207 PolarHBondContact O-N 2.98Å; D205-R207 VanDerWaalsContact O-N 3.12Å; D205-R207 VanDerWaalsContact OD1-CB 3.27Å; D205-R207 WeakPolarHBondContact OD1-CB 3.44Å; D205-R207 WeakPolarHBondContact OD1-CG 3.44Å; D205-R207 PolarHBondContact OD1-N 3.47Å; D205-T208 WeakPolarHBondContact CB-OG1 3.39Å; D205-T208 PolarHBondContact OD1-N 2.71Å; D205-T208 VanDerWaalsContact OD2-CG2 3.31Å; D205-T208 WeakPolarHBondContact OD2-CG2 3.05Å; D205-T208 PolarHBondContact OD2-OG1 3.03Å; D205-G209 VanDerWaalsContact O-CA 3.3Å; D205-G209 WeakPolarHBondContact O-CA 3.49Å; D205-G209 PolarHBondContact O-N 2.82Å; D205-I210 PolarHBondContact N-O 3.31Å; D205-Y212 HydrophobicContact CB-CD2 4.34Å; D205-Y212 HydrophobicContact CB-CE2 3.83Å
206	D	98.7	Very high	98.5	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.027	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.3	-175.6	90.3	-53.4	0	0	0	113.4	E190 K237 A238	E190-D206 VanDerWaalsContact CB-OD1 3.27Å; E190-D206 WeakPolarHBondContact CB-OD1 3.41Å; E190-D206 PolarHBondContact O-N 2.74Å; D206-K237 HydrophobicContact CB-CG 3.86Å; D206-K237 WeakPolarHBondContact O-CA 3.44Å; D206-K237 WeakPolarHBondContact OD2-CE 3.47Å; D206-K237 WeakPolarHBondContact OD2-CG 3.4Å; D206-K237 IonicContact OD2-NZ 3.67Å; D206-K237 PolarHBondContact OD2-NZ 2.81Å; D206-A238 VanDerWaalsContact CB-O 3.3Å; D206-A238 WeakPolarHBondContact CB-O 3.49Å
207	R	98.6	Very high	98.3	Very high	62 Å²	62	30.8 Å²	30.8	23%	0.234	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-48.8	-178	-42.8	-51	-53.7	163	2.3	111.3	R187 E190 D205	R187-R207 HydrophobicContact CB-CB 4.15Å; R187-R207 HydrophobicContact CB-CG 3.89Å; R187-R207 VanDerWaalsContact CZ-CZ 3.5Å; E190-R207 HydrophobicContact CB-CG 3.81Å; E190-R207 VanDerWaalsContact CD-CG 3.49Å; E190-R207 HydrophobicContact CG-CG 3.91Å; E190-R207 WeakPolarHBondContact OE1-CG 3.32Å; E190-R207 WeakPolarHBondContact OE2-CD 3.37Å; D205-R207 PolarHBondContact O-N 2.98Å; D205-R207 VanDerWaalsContact O-N 3.12Å; D205-R207 VanDerWaalsContact OD1-CB 3.27Å; D205-R207 WeakPolarHBondContact OD1-CB 3.44Å; D205-R207 WeakPolarHBondContact OD1-CG 3.44Å; D205-R207 PolarHBondContact OD1-N 3.47Å
208	T	98.8	Very high	98.3	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.049	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-18.4	-178.3	60.8	0	0	0	0	112.7	E184 D205 I210	E184-T208 HydrophobicContact CB-CG2 4.22Å; D205-T208 WeakPolarHBondContact CB-OG1 3.39Å; D205-T208 PolarHBondContact OD1-N 2.71Å; D205-T208 VanDerWaalsContact OD2-CG2 3.31Å; D205-T208 WeakPolarHBondContact OD2-CG2 3.05Å; D205-T208 PolarHBondContact OD2-OG1 3.03Å; T208-I210 HydrophobicContact CG2-CD1 4.35Å; T208-I210 PolarHBondContact O-N 2.95Å; T208-I210 WeakPolarHBondContact OG1-CB 3.1Å; T208-I210 WeakPolarHBondContact OG1-CG1 3.3Å; T208-I210 PolarHBondContact OG1-N 2.87Å
209	G	98.7	Very high	98.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.169	C	C	.	.			trans	66.3	17.5	-168.6	0	0	0	0	0	112.9	D205 L225	D205-G209 VanDerWaalsContact O-CA 3.3Å; D205-G209 WeakPolarHBondContact O-CA 3.49Å; D205-G209 PolarHBondContact O-N 2.82Å; G209-L225 VanDerWaalsContact O-CB 3.31Å; G209-L225 WeakPolarHBondContact O-CB 3.48Å; G209-L225 WeakPolarHBondContact O-CG 3.27Å; G209-L225 PolarHBondContact O-N 2.93Å
210	I	98.9	Very high	98.3	Very high	14 Å²	14	38.3 Å²	38.3	7%	0.072	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	124.5	-179.8	-64.5	171.7	0	0	0	109.6	L182 V204 D205 T208 Y212 P221 V223 I224	L182-I210 HydrophobicContact CB-CD1 4.25Å; L182-I210 HydrophobicContact CD1-CD1 3.72Å; V204-I210 WeakPolarHBondContact CA-O 3.36Å; D205-I210 PolarHBondContact N-O 3.31Å; T208-I210 HydrophobicContact CG2-CD1 4.35Å; T208-I210 PolarHBondContact O-N 2.95Å; T208-I210 WeakPolarHBondContact OG1-CB 3.1Å; T208-I210 WeakPolarHBondContact OG1-CG1 3.3Å; T208-I210 PolarHBondContact OG1-N 2.87Å; I210-Y212 HydrophobicContact CB-CD2 4.25Å; I210-Y212 HydrophobicContact CB-CE2 3.76Å; I210-Y212 HydrophobicContact CG2-CD1 4.33Å; I210-Y212 HydrophobicContact CG2-CD2 3.78Å; I210-Y212 HydrophobicContact CG2-CE1 4.17Å; I210-Y212 HydrophobicContact CG2-CE2 3.56Å; I210-Y212 HydrophobicContact CG2-CG 4.17Å; I210-Y212 WeakPolarHBondContact O-CD2 3.47Å; I210-P221 HydrophobicContact CG2-CB 3.94Å; I210-V223 CarbonylContact C-O 3.55Å; I210-V223 WeakPolarHBondContact CA-O 3.43Å; I210-I224 HydrophobicContact CD1-CD1 4.39Å; I210-I224 HydrophobicContact CG1-CB 4.14Å; I210-I224 HydrophobicContact CG1-CD1 3.95Å; I210-I224 HydrophobicContact CG1-CG1 3.89Å
211	I	98.9	Very high	98.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.5	164.1	-50.7	178	0	0	0	107.8	Y202 S203 V204 W222 V223 L225 L248 I250 V275	Y202-I211 HydrophobicContact CD1-CG2 3.76Å; Y202-I211 HydrophobicContact CG-CG2 4.3Å; S203-I211 CarbonylContact O-C 3.53Å; S203-I211 WeakPolarHBondContact O-CA 3.37Å; V204-I211 HydrophobicContact CG2-CG1 4.1Å; I211-W222 HydrophobicContact CB-CE3 4.39Å; I211-W222 HydrophobicContact CG2-CE3 3.97Å; I211-W222 PolarHBondContact O-N 3.1Å; I211-V223 HydrophobicContact CB-CB 4.49Å; I211-V223 HydrophobicContact CD1-CB 4.23Å; I211-V223 HydrophobicContact CD1-CG1 4.42Å; I211-V223 PolarHBondContact N-O 2.86Å; I211-L225 HydrophobicContact CD1-CD1 4.04Å; I211-L225 HydrophobicContact CD1-CD2 4.46Å; I211-L225 HydrophobicContact CD1-CG 4.4Å; I211-L225 HydrophobicContact CG1-CD1 3.98Å; I211-L225 HydrophobicContact CG1-CG 4.34Å; I211-L248 HydrophobicContact CD1-CD2 4.04Å; I211-I250 HydrophobicContact CD1-CD1 3.76Å; I211-I250 HydrophobicContact CD1-CG1 4.06Å; I211-V275 HydrophobicContact CD1-CG2 4.19Å
212	Y	98.9	Very high	98.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130	176.4	-70.8	-92	0	0	0	110.7	S180 M189 L191 Y202 S203 D205 I210 A219 V220 P221	S180-Y212 PolarHBondContact OG-OH 2.9Å; M189-Y212 HydrophobicContact SD-CE1 4.35Å; M189-Y212 HydrophobicContact SD-CE2 4.08Å; L191-Y212 HydrophobicContact CD2-CD2 4.46Å; Y202-Y212 VanDerWaalsContact CA-O 3.32Å; Y202-Y212 WeakPolarHBondContact CA-O 3.24Å; S203-Y212 PolarHBondContact N-O 2.96Å; S203-Y212 PolarHBondContact O-N 3.44Å; D205-Y212 HydrophobicContact CB-CD2 4.34Å; D205-Y212 HydrophobicContact CB-CE2 3.83Å; I210-Y212 HydrophobicContact CB-CD2 4.25Å; I210-Y212 HydrophobicContact CB-CE2 3.76Å; I210-Y212 HydrophobicContact CG2-CD1 4.33Å; I210-Y212 HydrophobicContact CG2-CD2 3.78Å; I210-Y212 HydrophobicContact CG2-CE1 4.17Å; I210-Y212 HydrophobicContact CG2-CE2 3.56Å; I210-Y212 HydrophobicContact CG2-CG 4.17Å; I210-Y212 WeakPolarHBondContact O-CD2 3.47Å; Y212-A219 HydrophobicContact CD1-CB 3.63Å; Y212-A219 HydrophobicContact CE1-CB 4.21Å; Y212-A219 HydrophobicContact CG-CB 4.03Å; Y212-V220 CarbonylContact C-O 3.59Å; Y212-V220 WeakPolarHBondContact CA-O 3.24Å; Y212-P221 HydrophobicContact CD1-CB 4.47Å; Y212-P221 HydrophobicContact CD1-CG 4.03Å; Y212-P221 HydrophobicContact CE1-CB 4.37Å; Y212-P221 HydrophobicContact CE1-CG 3.66Å
213	H	98.7	Very high	98.3	Very high	46 Å²	46	41.3 Å²	41.3	21%	0.213	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	123.8	162.1	174.2	-128.5	0	0	0	109.1	L201 Y202 D215 V220	L201-H213 PolarHBondContact O-CD2 3.42Å; Y202-H213 HydrophobicContact CD1-CB 4.06Å; Y202-H213 HydrophobicContact CE1-CB 3.69Å; H213-D215 PolarHBondContact O-N 2.84Å; H213-V220 HydrophobicContact CB-CB 4.38Å; H213-V220 PolarHBondContact N-O 3.41Å; H213-V220 PolarHBondContact O-N 2.74Å
214	I	98.7	Very high	98.3	Very high	9 Å²	9	46.7 Å²	46.7	5%	0.046	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	93.2	-179.2	-51.3	-52.1	0	0	0	109.2	M153 L178 L201 K218 A219	M153-I214 HydrophobicContact SD-CG2 4.32Å; L178-I214 HydrophobicContact CD1-CD1 4.09Å; L178-I214 HydrophobicContact CD1-CG2 4.09Å; L178-I214 HydrophobicContact CD2-CG2 4.02Å; L201-I214 HydrophobicContact CB-CB 4.36Å; L201-I214 HydrophobicContact CD2-CB 4.11Å; L201-I214 HydrophobicContact CD2-CG2 4.19Å; L201-I214 HydrophobicContact CG-CB 4.18Å; L201-I214 PolarHBondContact O-N 2.97Å; I214-K218 WeakPolarHBondContact CA-O 3.3Å; I214-A219 HydrophobicContact CD1-CB 4.05Å
215	D	97.4	Very high	98.3	Very high	70 Å²	70	46.7 Å²	46.7	37%	0.374	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	97.4	173.9	179.3	22	0	0	0	109.7	H213 D217 K218	H213-D215 PolarHBondContact O-N 2.84Å; D215-D217 PolarHBondContact O-N 3.42Å; D215-K218 PolarHBondContact N-O 2.69Å; D215-K218 WeakPolarHBondContact O-CB 3.26Å; D215-K218 PolarHBondContact O-N 2.85Å
216	R	94	Very high	98.3	Very high	199 Å²	199	48.8 Å²	48.8	75%	0.751	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	-94.5	-178.9	-54.2	168.2	-170.2	-159.5	-1.9	112.8	V176	V176-R216 WeakPolarHBondContact CG1-O 3.38Å
217	D	95.1	Very high	98.3	Very high	98 Å²	98	48.7 Å²	48.7	52%	0.524	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	8.2	-177.5	62.3	-33.4	0	0	0	112.5	V176 D215	V176-D217 HydrophobicContact CG1-CB 4.15Å; D215-D217 PolarHBondContact O-N 3.42Å
218	K	98.1	Very high	98.3	Very high	117 Å²	117	45.8 Å²	45.8	51%	0.509	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	130.1	-175.4	-58.9	175	-171	170.2	0	111.6	I214 D215 V220	I214-K218 WeakPolarHBondContact CA-O 3.3Å; D215-K218 PolarHBondContact N-O 2.69Å; D215-K218 WeakPolarHBondContact O-CB 3.26Å; D215-K218 PolarHBondContact O-N 2.85Å; K218-V220 HydrophobicContact CB-CG2 4.2Å
219	A	98.6	Very high	98.2	Very high	14 Å²	14	48.4 Å²	48.4	12%	0.116	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	108.3	163.1	0	0	0	0	0	108.8	M189 Y212 I214	M189-A219 HydrophobicContact CE-CB 3.75Å; M189-A219 HydrophobicContact SD-CB 4.34Å; Y212-A219 HydrophobicContact CD1-CB 3.63Å; Y212-A219 HydrophobicContact CE1-CB 4.21Å; Y212-A219 HydrophobicContact CG-CB 4.03Å; I214-A219 HydrophobicContact CD1-CB 4.05Å
220	V	98.8	Very high	98.2	Very high	66 Å²	66	49.3 Å²	49.3	40%	0.4	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	115.1	-179.4	-176.9	0	0	0	0	109.4	Y212 H213 K218 W222	Y212-V220 CarbonylContact C-O 3.59Å; Y212-V220 WeakPolarHBondContact CA-O 3.24Å; H213-V220 HydrophobicContact CB-CB 4.38Å; H213-V220 PolarHBondContact N-O 3.41Å; H213-V220 PolarHBondContact O-N 2.74Å; K218-V220 HydrophobicContact CB-CG2 4.2Å; V220-W222 PolarHBondContact O-N 2.94Å
221	P	98.8	Very high	98.2	Very high	69 Å²	69	55.3 Å²	55.3	45%	0.448	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	133.6	177.3	-23.7	31.3	0	0	0	111.8	L182 I210 Y212	L182-P221 HydrophobicContact CD1-CB 4.32Å; L182-P221 HydrophobicContact CD1-CG 3.61Å; I210-P221 HydrophobicContact CG2-CB 3.94Å; Y212-P221 HydrophobicContact CD1-CB 4.47Å; Y212-P221 HydrophobicContact CD1-CG 4.03Å; Y212-P221 HydrophobicContact CE1-CB 4.37Å; Y212-P221 HydrophobicContact CE1-CG 3.66Å
222	W	98.8	Very high	98.2	Very high	76 Å²	76	57.3 Å²	57.3	29%	0.288	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	-55.7	179.9	178.8	45.7	0	0	0	112.7	F197 Y202 I211 V220 L248 V275	F197-W222 HydrophobicContact CD1-CH2 4.22Å; F197-W222 HydrophobicContact CD1-CZ3 4.37Å; F197-W222 AromaticContact CE1-CH2 3.9Å; F197-W222 HydrophobicContact CE1-CH2 3.9Å; F197-W222 HydrophobicContact CE1-CZ3 4.41Å; Y202-W222 AromaticContact CD1-CE3 3.85Å; Y202-W222 HydrophobicContact CD1-CE3 3.85Å; Y202-W222 HydrophobicContact CD1-CZ3 4.46Å; Y202-W222 HydrophobicContact CE1-CB 4.09Å; Y202-W222 AromaticContact CE1-CD2 3.58Å; Y202-W222 HydrophobicContact CE1-CD2 3.58Å; Y202-W222 AromaticContact CE1-CE3 3.25Å; Y202-W222 HydrophobicContact CE1-CE3 3.25Å; Y202-W222 AromaticContact CE1-CG 3.94Å; Y202-W222 HydrophobicContact CE1-CG 3.94Å; Y202-W222 AromaticContact CE1-CZ3 3.97Å; Y202-W222 HydrophobicContact CE1-CZ3 3.97Å; Y202-W222 AromaticContact CZ-CD2 3.94Å; Y202-W222 AromaticContact CZ-CE3 3.7Å; I211-W222 HydrophobicContact CB-CE3 4.39Å; I211-W222 HydrophobicContact CG2-CE3 3.97Å; I211-W222 PolarHBondContact O-N 3.1Å; V220-W222 PolarHBondContact O-N 2.94Å; W222-L248 HydrophobicContact CZ3-CD2 4.37Å; W222-V275 HydrophobicContact CH2-CG1 3.66Å; W222-V275 HydrophobicContact CZ2-CG1 4.49Å; W222-V275 HydrophobicContact CZ3-CG1 3.91Å
223	V	98.6	Very high	98.1	Very high	15 Å²	15	62.8 Å²	62.8	9%	0.091	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	146.1	-178.3	171.3	0	0	0	0	108.7	I210 I211 L225 V275 V281	I210-V223 CarbonylContact C-O 3.55Å; I210-V223 WeakPolarHBondContact CA-O 3.43Å; I211-V223 HydrophobicContact CB-CB 4.49Å; I211-V223 HydrophobicContact CD1-CB 4.23Å; I211-V223 HydrophobicContact CD1-CG1 4.42Å; I211-V223 PolarHBondContact N-O 2.86Å; V223-L225 HydrophobicContact CG1-CD2 3.88Å; V223-V275 HydrophobicContact CG2-CG1 4.22Å; V223-V281 HydrophobicContact CG1-CG2 3.58Å
224	I	98.7	Very high	98.1	Very high	112 Å²	112	64.1 Å²	64.1	57%	0.574	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.7	172.6	-173	166.9	0	0	0	110.2	I210	I210-I224 HydrophobicContact CD1-CD1 4.39Å; I210-I224 HydrophobicContact CG1-CB 4.14Å; I210-I224 HydrophobicContact CG1-CD1 3.95Å; I210-I224 HydrophobicContact CG1-CG1 3.89Å
225	L	98.9	Very high	98.1	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.346	C	S	.	.			trans	-113.5	107.1	-172.9	-57.1	176.5	0	0	0	110.5	G209 I211 V223 F236 I250 K273 V275 V281	G209-L225 VanDerWaalsContact O-CB 3.31Å; G209-L225 WeakPolarHBondContact O-CB 3.48Å; G209-L225 WeakPolarHBondContact O-CG 3.27Å; G209-L225 PolarHBondContact O-N 2.93Å; I211-L225 HydrophobicContact CD1-CD1 4.04Å; I211-L225 HydrophobicContact CD1-CD2 4.46Å; I211-L225 HydrophobicContact CD1-CG 4.4Å; I211-L225 HydrophobicContact CG1-CD1 3.98Å; I211-L225 HydrophobicContact CG1-CG 4.34Å; V223-L225 HydrophobicContact CG1-CD2 3.88Å; L225-F236 HydrophobicContact CB-CB 3.96Å; L225-F236 HydrophobicContact CD1-CD1 4.41Å; L225-F236 VanDerWaalsContact O-CB 3.31Å; L225-F236 WeakPolarHBondContact O-CB 3.24Å; L225-F236 PolarHBondContact O-N 2.87Å; L225-I250 HydrophobicContact CD1-CB 4.01Å; L225-I250 HydrophobicContact CD1-CD1 4.12Å; L225-I250 HydrophobicContact CD1-CG1 4.09Å; L225-I250 HydrophobicContact CD1-CG2 3.84Å; L225-K273 HydrophobicContact CB-CG 4.34Å; L225-K273 HydrophobicContact CD1-CB 4.26Å; L225-K273 HydrophobicContact CD1-CG 4.1Å; L225-K273 HydrophobicContact CD2-CB 3.99Å; L225-K273 HydrophobicContact CD2-CG 4.17Å; L225-K273 HydrophobicContact CG-CG 4.44Å; L225-V275 HydrophobicContact CD2-CG2 4.04Å; L225-V281 HydrophobicContact CD2-CG1 3.92Å; L225-V281 HydrophobicContact CD2-CG2 4.45Å
226	P	98.7	Very high	98.2	Very high	45 Å²	45	60.7 Å²	60.7	29%	0.292	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	150.3	169	-11.4	25.2	0	0	0	111.2	G230 V232 K273	P226-G230 WeakPolarHBondContact CB-O 3.32Å; P226-V232 WeakPolarHBondContact CB-O 3.21Å; P226-K273 WeakPolarHBondContact O-CE 3.44Å
227	D	98.8	Very high	98.4	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.016	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	158.5	-176.2	-174.6	40.5	0	0	0	114.1	D229 G230 V232 K234 F236 N268	D227-D229 PolarHBondContact O-N 2.88Å; D227-G230 PolarHBondContact O-N 3.33Å; D227-G230 VanDerWaalsContact O-N 3.15Å; D227-V232 HydrophobicContact CB-CB 3.9Å; D227-V232 HydrophobicContact CB-CG1 3.89Å; D227-V232 WeakPolarHBondContact O-CB 3.28Å; D227-K234 HydrophobicContact CB-CG 3.95Å; D227-K234 WeakPolarHBondContact CB-O 3.27Å; D227-K234 PolarHBondContact N-O 2.82Å; D227-K234 IonicContact OD1-NZ 2.61Å; D227-K234 WeakPolarHBondContact OD2-CE 3.48Å; D227-K234 IonicContact OD2-NZ 3.69Å; D227-K234 PolarHBondContact OD2-NZ 2.8Å; D227-F236 WeakPolarHBondContact OD1-CD2 3.38Å; D227-N268 WeakPolarHBondContact OD1-CB 3.36Å; D227-N268 VanDerWaalsContact OD2-CB 3.26Å; D227-N268 WeakPolarHBondContact OD2-CB 3.47Å; D227-N268 PolarHBondContact OD2-ND2 2.66Å
228	G	98.6	Very high	98.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	-123.1	176.5	0	0	0	0	0	113.8	G230 W271 K273	G228-G230 PolarHBondContact O-N 3.07Å; G228-W271 VanDerWaalsContact C-CG 3.46Å; G228-W271 WeakPolarHBondContact O-CB 3.45Å; G228-K273 WeakPolarHBondContact O-CE 3.27Å; G228-K273 PolarHBondContact O-NZ 3.42Å
229	D	98.5	Very high	98.6	Very high	63 Å²	63	43.2 Å²	43.2	34%	0.337	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-1	-177.9	75.2	-30.1	0	0	0	114.4	D227 N231 W271 H283	D227-D229 PolarHBondContact O-N 2.88Å; D229-N231 WeakPolarHBondContact OD1-CB 3.48Å; D229-N231 PolarHBondContact OD1-N 2.85Å; D229-N231 PolarHBondContact OD2-ND2 3.36Å; D229-W271 HydrophobicContact CB-CD2 4.26Å; D229-W271 HydrophobicContact CB-CE3 4.2Å; D229-W271 HydrophobicContact CB-CH2 3.55Å; D229-W271 HydrophobicContact CB-CZ2 3.62Å; D229-W271 HydrophobicContact CB-CZ3 3.86Å; D229-H283 WeakPolarHBondContact O-CB 3.38Å
230	G	98.4	Very high	98.6	Very high	19 Å²	19	42.6 Å²	42.6	20%	0.196	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.8	-9.7	-176.1	0	0	0	0	0	114.7	P226 D227 G228 H283	P226-G230 WeakPolarHBondContact CB-O 3.32Å; D227-G230 PolarHBondContact O-N 3.33Å; D227-G230 VanDerWaalsContact O-N 3.15Å; G228-G230 PolarHBondContact O-N 3.07Å; G230-H283 WeakPolarHBondContact CA-CE1 3.02Å; G230-H283 WeakPolarHBondContact CA-ND1 3.38Å; G230-H283 PolarHBondContact N-ND1 2.72Å
231	N	98.3	Very high	98.6	Very high	141 Å²	141	39.4 Å²	39.4	75%	0.754	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.8	8	179.7	-62.1	-64.5	0	0	0	113.2	D229	D229-N231 WeakPolarHBondContact OD1-CB 3.48Å; D229-N231 PolarHBondContact OD1-N 2.85Å; D229-N231 PolarHBondContact OD2-ND2 3.36Å
232	V	98.4	Very high	98.6	Very high	42 Å²	42	36.3 Å²	36.3	26%	0.255	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	123.5	-179.7	-175.7	0	0	0	0	110.1	P226 D227 K234	P226-V232 WeakPolarHBondContact CB-O 3.21Å; D227-V232 HydrophobicContact CB-CB 3.9Å; D227-V232 HydrophobicContact CB-CG1 3.89Å; D227-V232 WeakPolarHBondContact O-CB 3.28Å; V232-K234 HydrophobicContact CG1-CG 3.95Å; V232-K234 PolarHBondContact O-N 3.35Å; V232-K234 VanDerWaalsContact O-N 3.08Å
233	A	97.8	Very high	98.7	Very high	115 Å²	115	34.5 Å²	34.5	95%	0.95	21%	0.206	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72	-0.5	-169.1	0	0	0	0	0	116.8
234	K	98.3	Very high	98.7	Very high	73 Å²	73	34.9 Å²	34.9	32%	0.317	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	156.6	173.7	64.5	167	-172.6	84.1	0	110.6	E184 D227 V232	E184-K234 WeakPolarHBondContact OE1-CB 3.41Å; E184-K234 WeakPolarHBondContact OE2-CA 3.28Å; D227-K234 HydrophobicContact CB-CG 3.95Å; D227-K234 WeakPolarHBondContact CB-O 3.27Å; D227-K234 PolarHBondContact N-O 2.82Å; D227-K234 IonicContact OD1-NZ 2.61Å; D227-K234 WeakPolarHBondContact OD2-CE 3.48Å; D227-K234 IonicContact OD2-NZ 3.69Å; D227-K234 PolarHBondContact OD2-NZ 2.8Å; V232-K234 HydrophobicContact CG1-CG 3.95Å; V232-K234 PolarHBondContact O-N 3.35Å; V232-K234 VanDerWaalsContact O-N 3.08Å
235	G	98.7	Very high	98.6	Very high	8 Å²	8	34 Å²	34	8%	0.082	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.7	142.2	168.9	0	0	0	0	0	112.9	E184	E184-G235 PolarHBondContact OE2-N 2.92Å
236	F	98.9	Very high	98.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.2	127.6	169.2	-178.2	-123.6	0	0	0	109.8	L225 D227 A238 I250 W271 K273	L225-F236 HydrophobicContact CB-CB 3.96Å; L225-F236 HydrophobicContact CD1-CD1 4.41Å; L225-F236 VanDerWaalsContact O-CB 3.31Å; L225-F236 WeakPolarHBondContact O-CB 3.24Å; L225-F236 PolarHBondContact O-N 2.87Å; D227-F236 WeakPolarHBondContact OD1-CD2 3.38Å; F236-A238 VanDerWaalsContact C-N 3.29Å; F236-A238 HydrophobicContact CD1-CB 3.97Å; F236-A238 HydrophobicContact CE1-CB 4.24Å; F236-A238 PolarHBondContact O-N 2.81Å; F236-I250 HydrophobicContact CD1-CG2 4.41Å; F236-I250 HydrophobicContact CE1-CG2 4.21Å; F236-W271 WeakPolarHBondContact CE2-O 3.26Å; F236-W271 WeakPolarHBondContact CZ-O 3.48Å; F236-K273 HydrophobicContact CD1-CD 4.49Å; F236-K273 HydrophobicContact CD1-CG 3.77Å; F236-K273 HydrophobicContact CE1-CG 3.91Å; F236-K273 HydrophobicContact CG-CG 4.3Å
237	K	98.8	Very high	98.6	Very high	45 Å²	45	39.3 Å²	39.3	20%	0.196	22%	0.224	C	C	.	.			trans	-76.1	88	172.4	-156.6	-171.4	-178.5	-44.9	0	108.3	D206 E239 G252 W257	D206-K237 HydrophobicContact CB-CG 3.86Å; D206-K237 WeakPolarHBondContact O-CA 3.44Å; D206-K237 WeakPolarHBondContact OD2-CE 3.47Å; D206-K237 WeakPolarHBondContact OD2-CG 3.4Å; D206-K237 IonicContact OD2-NZ 3.67Å; D206-K237 PolarHBondContact OD2-NZ 2.81Å; K237-E239 WeakPolarHBondContact CD-OE1 3.44Å; K237-E239 WeakPolarHBondContact CE-OE1 3.42Å; K237-E239 VanDerWaalsContact CG-OE1 3.29Å; K237-E239 WeakPolarHBondContact CG-OE1 3.32Å; K237-E239 IonicContact NZ-OE1 2.73Å; K237-E239 PolarHBondContact NZ-OE1 2.82Å; K237-E239 IonicContact NZ-OE2 3.5Å; K237-E239 PolarHBondContact NZ-OE2 3.09Å; K237-G252 VanDerWaalsContact O-CA 3.28Å; K237-G252 WeakPolarHBondContact O-CA 3.34Å; K237-W257 HydrophobicContact CD-CZ3 4.36Å
238	A	98.8	Very high	98.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.			trans	-82.5	129.6	179.6	0	0	0	0	0	109.6	V204 D206 F236 I250 G251	V204-A238 HydrophobicContact CB-CB 4.25Å; V204-A238 HydrophobicContact CG1-CB 3.63Å; V204-A238 HydrophobicContact CG2-CB 3.56Å; D206-A238 VanDerWaalsContact CB-O 3.3Å; D206-A238 WeakPolarHBondContact CB-O 3.49Å; F236-A238 VanDerWaalsContact C-N 3.29Å; F236-A238 HydrophobicContact CD1-CB 3.97Å; F236-A238 HydrophobicContact CE1-CB 4.24Å; F236-A238 PolarHBondContact O-N 2.81Å; A238-I250 HydrophobicContact CB-CG2 3.51Å; A238-G251 CarbonylContact C-O 3.6Å; A238-G251 WeakPolarHBondContact CA-O 3.5Å
239	E	98.9	Very high	98.7	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.009	23%	0.228	C	C	.	.			trans	-127.6	-8.6	-173.4	-46	-74.7	-172.3	0	0	112.5	K237 G251 L253 E308	K237-E239 WeakPolarHBondContact CD-OE1 3.44Å; K237-E239 WeakPolarHBondContact CE-OE1 3.42Å; K237-E239 VanDerWaalsContact CG-OE1 3.29Å; K237-E239 WeakPolarHBondContact CG-OE1 3.32Å; K237-E239 IonicContact NZ-OE1 2.73Å; K237-E239 PolarHBondContact NZ-OE1 2.82Å; K237-E239 IonicContact NZ-OE2 3.5Å; K237-E239 PolarHBondContact NZ-OE2 3.09Å; E239-G251 PolarHBondContact N-O 2.84Å; E239-L253 HydrophobicContact CG-CD2 3.95Å; E239-L253 HydrophobicContact CG-CG 4.05Å; E239-L253 WeakPolarHBondContact OE1-CD2 3.36Å; E239-L253 VanDerWaalsContact OE1-CG 3.25Å; E239-L253 WeakPolarHBondContact OE1-CG 3.29Å; E239-E308 HydrophobicContact CB-CB 4.39Å; E239-E308 HydrophobicContact CB-CG 4.1Å; E239-E308 CarbonylContact O-C 3.53Å; E239-E308 VanDerWaalsContact O-C 3.24Å; E239-E308 WeakPolarHBondContact O-CA 3.38Å
240	W	98.9	Very high	98.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	151.3	177.8	57.5	-98.5	0	0	0	112.6	D193 A242 I250 G251 G252 V272 W286 Y290 A310 W319 F321	D193-W240 WeakPolarHBondContact OD2-CA 3.21Å; W240-A242 HydrophobicContact CE3-CB 4.38Å; W240-A242 HydrophobicContact CZ3-CB 4.23Å; W240-I250 WeakPolarHBondContact O-CA 3.33Å; W240-G251 PolarHBondContact N-O 2.83Å; W240-G251 PolarHBondContact O-N 3.36Å; W240-G252 PolarHBondContact NE1-O 2.85Å; W240-V272 HydrophobicContact CH2-CG1 3.97Å; W240-V272 HydrophobicContact CH2-CG2 3.91Å; W240-V272 HydrophobicContact CZ2-CG2 3.76Å; W240-W286 HydrophobicContact CH2-CH2 4.04Å; W240-W286 AromaticContact CH2-CZ3 3.82Å; W240-W286 HydrophobicContact CH2-CZ3 3.82Å; W240-W286 HydrophobicContact CZ2-CE3 4.42Å; W240-W286 HydrophobicContact CZ2-CZ3 4.04Å; W240-Y290 WeakPolarHBondContact CZ2-OH 3.41Å; W240-A310 HydrophobicContact CD2-CB 3.65Å; W240-A310 HydrophobicContact CE3-CB 3.55Å; W240-A310 HydrophobicContact CG-CB 4.16Å; W240-A310 HydrophobicContact CH2-CB 4.33Å; W240-A310 HydrophobicContact CZ2-CB 4.41Å; W240-A310 HydrophobicContact CZ3-CB 3.92Å; W240-W319 HydrophobicContact CZ3-CZ3 4.41Å; W240-F321 HydrophobicContact CZ2-CE1 4.3Å
241	L	98.9	Very high	98.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.9	180	-64.5	175.6	0	0	0	111.2	D193 V195 V204 L248 Y249 I250	D193-L241 HydrophobicContact CB-CB 4.06Å; D193-L241 HydrophobicContact CB-CD1 4.01Å; D193-L241 HydrophobicContact CB-CG 3.84Å; D193-L241 PolarHBondContact OD2-N 3.23Å; V195-L241 HydrophobicContact CB-CB 3.84Å; V195-L241 HydrophobicContact CB-CD1 4.22Å; V195-L241 HydrophobicContact CG1-CB 3.92Å; V195-L241 HydrophobicContact CG1-CD1 3.74Å; V195-L241 HydrophobicContact CG1-CG 4.37Å; V195-L241 HydrophobicContact CG2-CB 4.39Å; V204-L241 HydrophobicContact CB-CD1 4.35Å; V204-L241 HydrophobicContact CB-CD2 4.34Å; V204-L241 HydrophobicContact CG1-CD1 3.99Å; V204-L241 HydrophobicContact CG1-CD2 3.97Å; V204-L241 HydrophobicContact CG1-CG 4.03Å; L241-L248 HydrophobicContact CB-CD1 4.3Å; L241-L248 HydrophobicContact CD2-CD1 4.23Å; L241-Y249 WeakPolarHBondContact CA-O 3.13Å; L241-I250 HydrophobicContact CD2-CB 3.94Å; L241-I250 HydrophobicContact CD2-CG1 3.35Å; L241-I250 HydrophobicContact CD2-CG2 3.71Å
242	A	98.9	Very high	98.7	Very high	4 Å²	4	29.9 Å²	29.9	3%	0.033	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.6	177.1	0	0	0	0	0	111.7	W240 Y249 W319	W240-A242 HydrophobicContact CE3-CB 4.38Å; W240-A242 HydrophobicContact CZ3-CB 4.23Å; A242-Y249 PolarHBondContact N-O 3.21Å; A242-Y249 PolarHBondContact O-N 3.39Å; A242-W319 HydrophobicContact CB-CH2 4.07Å; A242-W319 HydrophobicContact CB-CZ3 3.59Å
243	V	98.9	Very high	98.7	Very high	38 Å²	38	28.6 Å²	28.6	23%	0.23	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	134.1	176.9	179.8	0	0	0	0	110.2	V195 F197 H247 L248	V195-V243 HydrophobicContact CG2-CG2 3.83Å; F197-V243 HydrophobicContact CB-CG2 4.01Å; F197-V243 HydrophobicContact CD2-CB 4.38Å; F197-V243 HydrophobicContact CD2-CG1 3.77Å; F197-V243 HydrophobicContact CD2-CG2 3.64Å; F197-V243 HydrophobicContact CE2-CG1 4.08Å; F197-V243 HydrophobicContact CG-CG2 4.2Å; V243-H247 WeakPolarHBondContact CA-O 3.43Å; V243-L248 HydrophobicContact CG2-CD1 4.24Å
244	K	98.8	Very high	98.8	Very high	23 Å²	23	23.2 Å²	23.2	10%	0.1	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	135.6	174.7	174.8	179.1	-165.7	-37.6	0	109.8	E246 H247 Y249 W312 W319	K244-E246 VanDerWaalsContact C-N 3.31Å; K244-E246 PolarHBondContact O-N 2.9Å; K244-H247 PolarHBondContact N-O 2.81Å; K244-H247 PolarHBondContact O-N 2.63Å; K244-Y249 HydrophobicContact CB-CD2 3.98Å; K244-Y249 HydrophobicContact CB-CE2 3.72Å; K244-Y249 HydrophobicContact CD-CE2 4.42Å; K244-Y249 HydrophobicContact CG-CE2 4.33Å; K244-W312 HydrophobicContact CB-CB 3.92Å; K244-W312 HydrophobicContact CB-CD2 4.3Å; K244-W312 HydrophobicContact CB-CG 3.67Å; K244-W312 HydrophobicContact CD-CD2 3.59Å; K244-W312 HydrophobicContact CD-CE3 3.83Å; K244-W312 HydrophobicContact CD-CG 3.88Å; K244-W312 HydrophobicContact CD-CZ2 4.38Å; K244-W312 HydrophobicContact CD-CZ3 4.34Å; K244-W312 HydrophobicContact CG-CB 4.42Å; K244-W312 HydrophobicContact CG-CD2 3.81Å; K244-W312 HydrophobicContact CG-CG 3.7Å; K244-W319 HydrophobicContact CB-CH2 4.45Å; K244-W319 HydrophobicContact CB-CZ2 4.23Å; K244-W319 HydrophobicContact CD-CZ2 3.67Å
245	D	98.2	Very high	98.8	Very high	92 Å²	92	20.1 Å²	20.1	49%	0.492	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.8	48.4	175.8	-49.6	-7.6	0	0	0	113.2	H247	D245-H247 PolarHBondContact O-N 2.84Å; D245-H247 VanDerWaalsContact O-N 3.16Å; D245-H247 PolarHBondContact O-ND1 3.19Å
246	E	98.5	Very high	98.8	Very high	99 Å²	99	21.7 Å²	21.7	46%	0.463	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	14.7	-177	-47.8	-173.9	162.1	0	0	115.9	Y111 F197 K244 F277	Y111-E246 VanDerWaalsContact CB-CD 3.45Å; Y111-E246 HydrophobicContact CD1-CB 4.1Å; Y111-E246 HydrophobicContact CD1-CG 3.65Å; Y111-E246 HydrophobicContact CD2-CB 3.96Å; Y111-E246 HydrophobicContact CD2-CG 4.39Å; Y111-E246 HydrophobicContact CE1-CB 4.48Å; Y111-E246 HydrophobicContact CE1-CG 4.2Å; Y111-E246 HydrophobicContact CE2-CB 4.34Å; Y111-E246 HydrophobicContact CG-CB 3.83Å; Y111-E246 HydrophobicContact CG-CG 3.76Å; F197-E246 WeakPolarHBondContact CE2-O 3.38Å; F197-E246 VanDerWaalsContact CZ-O 3.29Å; F197-E246 WeakPolarHBondContact CZ-O 3.4Å; K244-E246 VanDerWaalsContact C-N 3.31Å; K244-E246 PolarHBondContact O-N 2.9Å; E246-F277 HydrophobicContact CB-CD1 4.45Å
247	H	98.8	Very high	98.7	Very high	58 Å²	58	26.9 Å²	26.9	27%	0.269	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	145	174.4	-62.9	72.2	0	0	0	111.9	V243 K244 D245 Y249 V274	V243-H247 WeakPolarHBondContact CA-O 3.43Å; K244-H247 PolarHBondContact N-O 2.81Å; K244-H247 PolarHBondContact O-N 2.63Å; D245-H247 PolarHBondContact O-N 2.84Å; D245-H247 VanDerWaalsContact O-N 3.16Å; D245-H247 PolarHBondContact O-ND1 3.19Å; H247-Y249 HydrophobicContact CB-CD2 4.47Å; H247-Y249 HydrophobicContact CB-CE2 4.05Å; H247-V274 HydrophobicContact CB-CG1 3.75Å
248	L	98.9	Very high	98.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118	170.7	176.4	63	0	0	0	109.6	V195 F197 I211 W222 L241 V243 I250 V275	V195-L248 HydrophobicContact CG1-CD1 3.76Å; V195-L248 HydrophobicContact CG2-CD1 4.34Å; F197-L248 HydrophobicContact CD1-CB 3.76Å; F197-L248 HydrophobicContact CD1-CD2 4.23Å; F197-L248 HydrophobicContact CD2-CB 4.18Å; F197-L248 HydrophobicContact CE1-CB 3.68Å; F197-L248 HydrophobicContact CE2-CB 4.13Å; F197-L248 HydrophobicContact CG-CB 4Å; F197-L248 HydrophobicContact CZ-CB 3.89Å; I211-L248 HydrophobicContact CD1-CD2 4.04Å; W222-L248 HydrophobicContact CZ3-CD2 4.37Å; L241-L248 HydrophobicContact CB-CD1 4.3Å; L241-L248 HydrophobicContact CD2-CD1 4.23Å; V243-L248 HydrophobicContact CG2-CD1 4.24Å; L248-I250 HydrophobicContact CD2-CD1 4.19Å; L248-I250 HydrophobicContact CD2-CG1 4.32Å; L248-I250 HydrophobicContact CG-CD1 3.89Å; L248-I250 HydrophobicContact CG-CG1 4.07Å; L248-I250 WeakPolarHBondContact O-CD1 3.41Å; L248-V275 HydrophobicContact CB-CB 4.38Å; L248-V275 PolarHBondContact N-O 2.88Å; L248-V275 PolarHBondContact O-N 3.07Å
249	Y	98.9	Very high	98.6	Very high	29 Å²	29	27.8 Å²	27.8	11%	0.114	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.8	172.9	-74	-104.3	0	0	0	109.5	L241 A242 K244 H247 V272 K273 V274 W286 W319	L241-Y249 WeakPolarHBondContact CA-O 3.13Å; A242-Y249 PolarHBondContact N-O 3.21Å; A242-Y249 PolarHBondContact O-N 3.39Å; K244-Y249 HydrophobicContact CB-CD2 3.98Å; K244-Y249 HydrophobicContact CB-CE2 3.72Å; K244-Y249 HydrophobicContact CD-CE2 4.42Å; K244-Y249 HydrophobicContact CG-CE2 4.33Å; H247-Y249 HydrophobicContact CB-CD2 4.47Å; H247-Y249 HydrophobicContact CB-CE2 4.05Å; Y249-V272 HydrophobicContact CD1-CG1 3.88Å; Y249-K273 WeakPolarHBondContact CA-O 3.21Å; Y249-V274 HydrophobicContact CD1-CG1 4.47Å; Y249-V274 HydrophobicContact CD1-CG2 3.67Å; Y249-V274 HydrophobicContact CD2-CG1 4.39Å; Y249-V274 HydrophobicContact CE1-CB 4.37Å; Y249-V274 HydrophobicContact CE1-CG1 4.04Å; Y249-V274 HydrophobicContact CE1-CG2 3.43Å; Y249-V274 VanDerWaalsContact CE1-CG2 3.43Å; Y249-V274 HydrophobicContact CE2-CG1 3.96Å; Y249-V274 HydrophobicContact CG-CG2 4.43Å; Y249-W286 HydrophobicContact CD1-CH2 4.3Å; Y249-W286 AromaticContact CD1-CZ2 3.82Å; Y249-W286 HydrophobicContact CD1-CZ2 3.82Å; Y249-W286 AromaticContact CE1-CZ2 3.95Å; Y249-W286 HydrophobicContact CE1-CZ2 3.95Å; Y249-W319 HydrophobicContact CD1-CH2 4.08Å; Y249-W319 HydrophobicContact CD1-CZ2 4.11Å; Y249-W319 HydrophobicContact CD2-CH2 4.07Å; Y249-W319 HydrophobicContact CD2-CZ2 4.31Å; Y249-W319 HydrophobicContact CE1-CZ2 4.31Å; Y249-W319 HydrophobicContact CE2-CZ2 4.49Å; Y249-W319 AromaticContact CG-CH2 3.75Å; Y249-W319 HydrophobicContact CG-CH2 3.75Å; Y249-W319 HydrophobicContact CG-CZ2 4.13Å
250	I	98.9	Very high	98.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	113.4	178	-48.3	95.7	0	0	0	108.5	I211 L225 F236 A238 W240 L241 L248 V272 K273 V275	I211-I250 HydrophobicContact CD1-CD1 3.76Å; I211-I250 HydrophobicContact CD1-CG1 4.06Å; L225-I250 HydrophobicContact CD1-CB 4.01Å; L225-I250 HydrophobicContact CD1-CD1 4.12Å; L225-I250 HydrophobicContact CD1-CG1 4.09Å; L225-I250 HydrophobicContact CD1-CG2 3.84Å; F236-I250 HydrophobicContact CD1-CG2 4.41Å; F236-I250 HydrophobicContact CE1-CG2 4.21Å; A238-I250 HydrophobicContact CB-CG2 3.51Å; W240-I250 WeakPolarHBondContact O-CA 3.33Å; L241-I250 HydrophobicContact CD2-CB 3.94Å; L241-I250 HydrophobicContact CD2-CG1 3.35Å; L241-I250 HydrophobicContact CD2-CG2 3.71Å; L248-I250 HydrophobicContact CD2-CD1 4.19Å; L248-I250 HydrophobicContact CD2-CG1 4.32Å; L248-I250 HydrophobicContact CG-CD1 3.89Å; L248-I250 HydrophobicContact CG-CG1 4.07Å; L248-I250 WeakPolarHBondContact O-CD1 3.41Å; I250-V272 WeakPolarHBondContact O-CA 3.29Å; I250-K273 HydrophobicContact CB-CB 4.28Å; I250-K273 HydrophobicContact CD1-CB 4.2Å; I250-K273 PolarHBondContact N-O 2.8Å; I250-K273 PolarHBondContact O-N 3.01Å; I250-V275 HydrophobicContact CD1-CB 4.08Å; I250-V275 HydrophobicContact CD1-CG2 3.4Å
251	G	98.9	Very high	98.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	173.3	175.8	0	0	0	0	0	113.2	A238 E239 W240	A238-G251 CarbonylContact C-O 3.6Å; A238-G251 WeakPolarHBondContact CA-O 3.5Å; E239-G251 PolarHBondContact N-O 2.84Å; W240-G251 PolarHBondContact N-O 2.83Å; W240-G251 PolarHBondContact O-N 3.36Å
252	G	98.7	Very high	98.2	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.			trans	-115.5	-160.1	175	0	0	0	0	0	111.2	K237 W240 G254	K237-G252 VanDerWaalsContact O-CA 3.28Å; K237-G252 WeakPolarHBondContact O-CA 3.34Å; W240-G252 PolarHBondContact NE1-O 2.85Å; G252-G254 PolarHBondContact O-N 3.4Å
253	L	98.8	Very high	98.1	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.079	20%	0.204	C	C	.	.			trans	-50.3	-20.8	-174.4	-61.5	168.2	0	0	0	115.4	E239 K255 W257 P269 I306 H307	E239-L253 HydrophobicContact CG-CD2 3.95Å; E239-L253 HydrophobicContact CG-CG 4.05Å; E239-L253 WeakPolarHBondContact OE1-CD2 3.36Å; E239-L253 VanDerWaalsContact OE1-CG 3.25Å; E239-L253 WeakPolarHBondContact OE1-CG 3.29Å; L253-K255 HydrophobicContact CB-CG 4.33Å; L253-K255 PolarHBondContact O-N 2.85Å; L253-W257 HydrophobicContact CD1-CE3 4.1Å; L253-W257 HydrophobicContact CD1-CZ3 3.91Å; L253-P269 HydrophobicContact CB-CB 3.95Å; L253-P269 HydrophobicContact CD1-CB 4.47Å; L253-P269 HydrophobicContact CG-CB 4.47Å; L253-I306 HydrophobicContact CB-CG2 4.45Å; L253-I306 HydrophobicContact CD2-CG2 3.54Å; L253-I306 WeakPolarHBondContact O-CA 3.13Å; L253-H307 PolarHBondContact O-N 3.48Å
254	G	98.4	Very high	98.1	Very high	1 Å²	1	46 Å²	46	1%	0.01	22%	0.22	C	C	.	.	S	Bend	trans	69.5	22.1	176.1	0	0	0	0	0	114.6	G252 P269 Y290	G252-G254 PolarHBondContact O-N 3.4Å; G254-P269 PolarHBondContact N-O 2.89Å; G254-Y290 VanDerWaalsContact CA-CD1 3.44Å; G254-Y290 VanDerWaalsContact CA-CZ 3.42Å; G254-Y290 WeakPolarHBondContact O-CB 3.44Å; G254-Y290 WeakPolarHBondContact O-CD1 3.39Å
255	K	98.4	Very high	98	Very high	8 Å²	8	48.5 Å²	48.5	4%	0.035	24%	0.237	C	C	.	.	S	Bend	trans	-139.3	166.7	171.1	67.9	166.4	-166.7	75.8	0	110.6	L253 W257 T258 Y304 F305 I306	L253-K255 HydrophobicContact CB-CG 4.33Å; L253-K255 PolarHBondContact O-N 2.85Å; K255-W257 PolarHBondContact O-N 2.91Å; K255-T258 PolarHBondContact NZ-OG1 2.99Å; K255-Y304 HydrophobicContact CD-CD2 3.88Å; K255-Y304 HydrophobicContact CD-CG 4.19Å; K255-F305 WeakPolarHBondContact CB-O 3.39Å; K255-I306 HydrophobicContact CD-CD1 4.46Å; K255-I306 HydrophobicContact CD-CG1 3.88Å; K255-I306 HydrophobicContact CG-CG1 4.47Å
256	E	98.4	Very high	98	Very high	41 Å²	41	46 Å²	46	19%	0.192	22%	0.224	C	C	.	.			trans	-50.9	133.7	169.1	-59.8	86.2	162.2	0	0	110.9	F264 K294	E256-F264 HydrophobicContact CB-CD2 3.86Å; E256-F264 HydrophobicContact CB-CE2 3.97Å; E256-F264 HydrophobicContact CG-CD2 4.01Å; E256-F264 HydrophobicContact CG-CE2 3.91Å; E256-K294 IonicContact OE1-NZ 3.45Å; E256-K294 PolarHBondContact OE1-NZ 3.28Å; E256-K294 IonicContact OE2-NZ 3.63Å; E256-K294 PolarHBondContact OE2-NZ 2.85Å
257	W	98.3	Very high	98	Very high	109 Å²	109	44 Å²	44	41%	0.413	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	133.5	167.7	-173.6	-95.5	0	0	0	108.8	K237 L253 K255 V265 N266 P269	K237-W257 HydrophobicContact CD-CZ3 4.36Å; L253-W257 HydrophobicContact CD1-CE3 4.1Å; L253-W257 HydrophobicContact CD1-CZ3 3.91Å; K255-W257 PolarHBondContact O-N 2.91Å; W257-V265 WeakPolarHBondContact O-CB 3.32Å; W257-V265 PolarHBondContact O-N 2.95Å; W257-N266 WeakPolarHBondContact CB-OD1 3.37Å; W257-N266 PolarHBondContact N-O 3.04Å; W257-N266 PolarHBondContact O-N 2.93Å; W257-P269 HydrophobicContact CB-CG 3.98Å; W257-P269 HydrophobicContact CE3-CG 4.05Å
258	T	98.1	Very high	98	Very high	21 Å²	21	42.7 Å²	42.7	13%	0.129	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	163.7	-173.4	51.5	0	0	0	0	111.8	K255 E263 Y331	K255-T258 PolarHBondContact NZ-OG1 2.99Å; T258-E263 CarbonylContact C-O 3.52Å; T258-E263 WeakPolarHBondContact CA-O 3.45Å; T258-E263 VanDerWaalsContact CB-O 3.28Å; T258-E263 WeakPolarHBondContact CB-O 3.28Å; T258-Y331 VanDerWaalsContact OG1-CD1 3.27Å; T258-Y331 WeakPolarHBondContact OG1-CD1 3.48Å
259	T	97.6	Very high	98	Very high	44 Å²	44	43 Å²	43	27%	0.27	21%	0.213	S	C	.	.			trans	-63.5	170.1	158.2	65.8	0	0	0	0	110.5	Q261 G262 E263 V265	T259-Q261 PolarHBondContact O-N 3.42Å; T259-Q261 VanDerWaalsContact O-N 3.16Å; T259-Q261 PolarHBondContact OG1-N 2.82Å; T259-G262 PolarHBondContact O-N 2.93Å; T259-E263 HydrophobicContact CG2-CB 4.06Å; T259-E263 PolarHBondContact N-O 3.32Å; T259-E263 WeakPolarHBondContact OG1-CB 3.26Å; T259-E263 PolarHBondContact OG1-N 3.06Å; T259-V265 HydrophobicContact CG2-CG2 4.25Å
260	T	96	Very high	98	Very high	53 Å²	53	41.6 Å²	41.6	33%	0.325	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.5	177.3	57	0	0	0	0	113	E332 E333	T260-E332 WeakPolarHBondContact O-CA 3.23Å; T260-E333 HydrophobicContact CG2-CB 4.32Å; T260-E333 VanDerWaalsContact CG2-CD 3.44Å; T260-E333 HydrophobicContact CG2-CG 4.49Å; T260-E333 WeakPolarHBondContact CG2-OE1 3.42Å; T260-E333 WeakPolarHBondContact CG2-OE2 3.19Å; T260-E333 PolarHBondContact O-N 2.88Å; T260-E333 VanDerWaalsContact O-N 3.11Å
261	Q	95.3	Very high	98	Very high	115 Å²	115	44.1 Å²	44.1	54%	0.537	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	7.1	171.2	-59.1	70.3	38.1	0	0	113.2	T259 R330 Y331	T259-Q261 PolarHBondContact O-N 3.42Å; T259-Q261 VanDerWaalsContact O-N 3.16Å; T259-Q261 PolarHBondContact OG1-N 2.82Å; Q261-R330 WeakPolarHBondContact O-CD 3.45Å; Q261-Y331 CarbonylContact C-O 3.42Å
262	G	95.8	Very high	98	Very high	5 Å²	5	44.1 Å²	44.1	5%	0.052	22%	0.217	C	C	.	.			trans	75.2	27.2	177.7	0	0	0	0	0	114.8	T259 R330 Y331	T259-G262 PolarHBondContact O-N 2.93Å; G262-R330 PolarHBondContact O-NH1 2.82Å; G262-Y331 WeakPolarHBondContact CA-O 3.48Å; G262-Y331 PolarHBondContact N-O 3.42Å
263	E	97.4	Very high	98	Very high	125 Å²	125	44.1 Å²	44.1	58%	0.584	22%	0.217	S	C	*	.			trans	-84.3	136.6	169.3	-56.5	-170.1	140.1	0	0	110.4	T258 T259	T258-E263 CarbonylContact C-O 3.52Å; T258-E263 WeakPolarHBondContact CA-O 3.45Å; T258-E263 VanDerWaalsContact CB-O 3.28Å; T258-E263 WeakPolarHBondContact CB-O 3.28Å; T259-E263 HydrophobicContact CG2-CB 4.06Å; T259-E263 PolarHBondContact N-O 3.32Å; T259-E263 WeakPolarHBondContact OG1-CB 3.26Å; T259-E263 PolarHBondContact OG1-N 3.06Å
264	F	97.9	Very high	98.1	Very high	128 Å²	128	43.6 Å²	43.6	56%	0.561	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.7	-175.5	176.3	-96.8	0	0	0	113.2	E256 N267	E256-F264 HydrophobicContact CB-CD2 3.86Å; E256-F264 HydrophobicContact CB-CE2 3.97Å; E256-F264 HydrophobicContact CG-CD2 4.01Å; E256-F264 HydrophobicContact CG-CE2 3.91Å; F264-N267 WeakPolarHBondContact CE2-OD1 3.43Å; F264-N267 WeakPolarHBondContact CZ-OD1 3.38Å
265	V	98.3	Very high	98.1	Very high	76 Å²	76	43.6 Å²	43.6	46%	0.461	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	-53.2	174.4	-175.2	0	0	0	0	112.3	W257 T259	W257-V265 WeakPolarHBondContact O-CB 3.32Å; W257-V265 PolarHBondContact O-N 2.95Å; T259-V265 HydrophobicContact CG2-CG2 4.25Å
266	N	98.4	Very high	98.1	Very high	39 Å²	39	43.3 Å²	43.3	21%	0.209	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	172.9	-179.8	64.3	66.7	0	0	0	112	W257 N268	W257-N266 WeakPolarHBondContact CB-OD1 3.37Å; W257-N266 PolarHBondContact N-O 3.04Å; W257-N266 PolarHBondContact O-N 2.93Å; N266-N268 WeakPolarHBondContact OD1-CB 3.07Å; N266-N268 PolarHBondContact OD1-N 3Å; N266-N268 PolarHBondContact OD1-OD1 2.8Å
267	N	98.5	Very high	98	Very high	58 Å²	58	43.1 Å²	43.1	31%	0.31	21%	0.212	S	C	.	.			trans	-102.7	17.1	177.8	-57.1	-30.5	0	0	0	112.7	F264 P269 E270 V287	F264-N267 WeakPolarHBondContact CE2-OD1 3.43Å; F264-N267 WeakPolarHBondContact CZ-OD1 3.38Å; N267-P269 VanDerWaalsContact C-CD 3.5Å; N267-E270 WeakPolarHBondContact CB-OE2 3.38Å; N267-E270 WeakPolarHBondContact O-CB 3.3Å; N267-E270 PolarHBondContact O-N 2.77Å; N267-E270 PolarHBondContact OD1-OE2 2.74Å; N267-V287 HydrophobicContact CB-CG2 3.95Å
268	N	98.9	Very high	97.9	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.16	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-61.6	-38	-169.1	-61.6	5.8	0	0	0	114.1	D227 N266 E270 W271	D227-N268 WeakPolarHBondContact OD1-CB 3.36Å; D227-N268 VanDerWaalsContact OD2-CB 3.26Å; D227-N268 WeakPolarHBondContact OD2-CB 3.47Å; D227-N268 PolarHBondContact OD2-ND2 2.66Å; N266-N268 WeakPolarHBondContact OD1-CB 3.07Å; N266-N268 PolarHBondContact OD1-N 3Å; N266-N268 PolarHBondContact OD1-OD1 2.8Å; N268-E270 PolarHBondContact O-N 2.82Å; N268-W271 PolarHBondContact O-N 3.41Å; N268-W271 VanDerWaalsContact O-N 3.15Å
269	P	98.8	Very high	97.9	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.032	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-69.4	-8.1	175.1	-15.9	30.5	0	0	0	114.4	L253 G254 W257 N267	L253-P269 HydrophobicContact CB-CB 3.95Å; L253-P269 HydrophobicContact CD1-CB 4.47Å; L253-P269 HydrophobicContact CG-CB 4.47Å; G254-P269 PolarHBondContact N-O 2.89Å; W257-P269 HydrophobicContact CB-CG 3.98Å; W257-P269 HydrophobicContact CE3-CG 4.05Å; N267-P269 VanDerWaalsContact C-CD 3.5Å
270	E	98.9	Very high	97.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-92.1	7.1	173.4	-61.3	177.1	96.5	0	0	112.8	N267 N268 W286 V287 Y290	N267-E270 WeakPolarHBondContact CB-OE2 3.38Å; N267-E270 WeakPolarHBondContact O-CB 3.3Å; N267-E270 PolarHBondContact O-N 2.77Å; N267-E270 PolarHBondContact OD1-OE2 2.74Å; N268-E270 PolarHBondContact O-N 2.82Å; E270-W286 CarbonylContact O-C 3.59Å; E270-W286 VanDerWaalsContact O-CA 3.28Å; E270-W286 WeakPolarHBondContact O-CA 3.4Å; E270-W286 VanDerWaalsContact O-CB 3.27Å; E270-W286 WeakPolarHBondContact O-CB 3.41Å; E270-W286 PolarHBondContact O-N 2.82Å; E270-V287 HydrophobicContact CB-CB 4.39Å; E270-V287 HydrophobicContact CB-CG2 3.54Å; E270-V287 HydrophobicContact CG-CG2 4.3Å; E270-V287 PolarHBondContact O-N 3.15Å; E270-Y290 HydrophobicContact CB-CD2 3.85Å; E270-Y290 HydrophobicContact CB-CE2 4.21Å; E270-Y290 HydrophobicContact CG-CD2 4.08Å
271	W	98.9	Very high	98	Very high	54 Å²	54	47.2 Å²	47.2	21%	0.205	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.7	169.1	-73	77	0	0	0	111	G228 D229 F236 N268 K273 H283 E284 N285	G228-W271 VanDerWaalsContact C-CG 3.46Å; G228-W271 WeakPolarHBondContact O-CB 3.45Å; D229-W271 HydrophobicContact CB-CD2 4.26Å; D229-W271 HydrophobicContact CB-CE3 4.2Å; D229-W271 HydrophobicContact CB-CH2 3.55Å; D229-W271 HydrophobicContact CB-CZ2 3.62Å; D229-W271 HydrophobicContact CB-CZ3 3.86Å; F236-W271 WeakPolarHBondContact CE2-O 3.26Å; F236-W271 WeakPolarHBondContact CZ-O 3.48Å; N268-W271 PolarHBondContact O-N 3.41Å; N268-W271 VanDerWaalsContact O-N 3.15Å; W271-K273 PolarHBondContact O-NZ 3.23Å; W271-H283 HydrophobicContact CE3-CB 4.19Å; W271-H283 HydrophobicContact CZ3-CB 4.3Å; W271-E284 CarbonylContact C-O 3.56Å; W271-E284 WeakPolarHBondContact CA-O 3.34Å; W271-N285 HydrophobicContact CD2-CB 4.21Å; W271-N285 HydrophobicContact CE3-CB 4.07Å; W271-N285 HydrophobicContact CH2-CB 3.88Å; W271-N285 HydrophobicContact CZ2-CB 4Å; W271-N285 HydrophobicContact CZ3-CB 3.91Å
272	V	98.9	Very high	98.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	142	174.9	173.2	0	0	0	0	109.4	W240 Y249 I250 E284 W286	W240-V272 HydrophobicContact CH2-CG1 3.97Å; W240-V272 HydrophobicContact CH2-CG2 3.91Å; W240-V272 HydrophobicContact CZ2-CG2 3.76Å; Y249-V272 HydrophobicContact CD1-CG1 3.88Å; I250-V272 WeakPolarHBondContact O-CA 3.29Å; V272-E284 PolarHBondContact N-O 2.66Å; V272-E284 PolarHBondContact O-N 3.29Å; V272-W286 HydrophobicContact CB-CD2 3.88Å; V272-W286 HydrophobicContact CB-CE3 4.49Å; V272-W286 HydrophobicContact CB-CG 3.93Å; V272-W286 HydrophobicContact CB-CZ2 4.43Å; V272-W286 HydrophobicContact CG1-CD2 4.49Å; V272-W286 HydrophobicContact CG1-CZ2 4.19Å; V272-W286 HydrophobicContact CG2-CB 4.02Å; V272-W286 HydrophobicContact CG2-CD2 3.38Å; V272-W286 HydrophobicContact CG2-CE3 3.59Å; V272-W286 HydrophobicContact CG2-CG 3.57Å; V272-W286 HydrophobicContact CG2-CZ2 4.44Å; V272-W286 HydrophobicContact CG2-CZ3 4.17Å
273	K	98.9	Very high	98.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.2	175.2	-42.6	-63.4	174.8	-85.8	0	107.5	L225 P226 G228 F236 Y249 I250 W271 Q282 H283	L225-K273 HydrophobicContact CB-CG 4.34Å; L225-K273 HydrophobicContact CD1-CB 4.26Å; L225-K273 HydrophobicContact CD1-CG 4.1Å; L225-K273 HydrophobicContact CD2-CB 3.99Å; L225-K273 HydrophobicContact CD2-CG 4.17Å; L225-K273 HydrophobicContact CG-CG 4.44Å; P226-K273 WeakPolarHBondContact O-CE 3.44Å; G228-K273 WeakPolarHBondContact O-CE 3.27Å; G228-K273 PolarHBondContact O-NZ 3.42Å; F236-K273 HydrophobicContact CD1-CD 4.49Å; F236-K273 HydrophobicContact CD1-CG 3.77Å; F236-K273 HydrophobicContact CE1-CG 3.91Å; F236-K273 HydrophobicContact CG-CG 4.3Å; Y249-K273 WeakPolarHBondContact CA-O 3.21Å; I250-K273 HydrophobicContact CB-CB 4.28Å; I250-K273 HydrophobicContact CD1-CB 4.2Å; I250-K273 PolarHBondContact N-O 2.8Å; I250-K273 PolarHBondContact O-N 3.01Å; W271-K273 PolarHBondContact O-NZ 3.23Å; K273-Q282 CarbonylContact C-O 3.55Å; K273-Q282 WeakPolarHBondContact CA-O 3.46Å; K273-H283 VanDerWaalsContact CD-ND1 3.31Å; K273-H283 WeakPolarHBondContact CD-ND1 3.11Å
274	V	98.9	Very high	98.4	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	115	178.9	-172	0	0	0	0	107.1	H247 Y249 Q282 E284	H247-V274 HydrophobicContact CB-CG1 3.75Å; Y249-V274 HydrophobicContact CD1-CG1 4.47Å; Y249-V274 HydrophobicContact CD1-CG2 3.67Å; Y249-V274 HydrophobicContact CD2-CG1 4.39Å; Y249-V274 HydrophobicContact CE1-CB 4.37Å; Y249-V274 HydrophobicContact CE1-CG1 4.04Å; Y249-V274 HydrophobicContact CE1-CG2 3.43Å; Y249-V274 VanDerWaalsContact CE1-CG2 3.43Å; Y249-V274 HydrophobicContact CE2-CG1 3.96Å; Y249-V274 HydrophobicContact CG-CG2 4.43Å; V274-Q282 HydrophobicContact CB-CB 4.33Å; V274-Q282 PolarHBondContact N-O 3.37Å; V274-Q282 PolarHBondContact O-N 3.39Å; V274-E284 HydrophobicContact CG2-CG 4Å
275	V	98.9	Very high	98.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	117.3	-171.4	-178.8	0	0	0	0	109.1	I211 W222 V223 L225 L248 I250 D280 V281	I211-V275 HydrophobicContact CD1-CG2 4.19Å; W222-V275 HydrophobicContact CH2-CG1 3.66Å; W222-V275 HydrophobicContact CZ2-CG1 4.49Å; W222-V275 HydrophobicContact CZ3-CG1 3.91Å; V223-V275 HydrophobicContact CG2-CG1 4.22Å; L225-V275 HydrophobicContact CD2-CG2 4.04Å; L248-V275 HydrophobicContact CB-CB 4.38Å; L248-V275 PolarHBondContact N-O 2.88Å; L248-V275 PolarHBondContact O-N 3.07Å; I250-V275 HydrophobicContact CD1-CB 4.08Å; I250-V275 HydrophobicContact CD1-CG2 3.4Å; V275-D280 CarbonylContact C-O 3.57Å; V275-D280 VanDerWaalsContact CA-O 3.24Å; V275-D280 WeakPolarHBondContact CA-O 3.37Å; V275-V281 HydrophobicContact CG2-CG1 4.25Å; V275-V281 HydrophobicContact CG2-CG2 4.19Å
276	G	98.5	Very high	98.5	Very high	2 Å²	2	39.4 Å²	39.4	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	158.2	173.6	0	0	0	0	0	111.2	R278 G279 D280	G276-R278 PolarHBondContact O-N 3.23Å; G276-G279 PolarHBondContact O-N 3.42Å; G276-D280 WeakPolarHBondContact CA-OD1 3.31Å; G276-D280 PolarHBondContact N-O 3.09Å
277	F	97.4	Very high	98.5	Very high	37 Å²	37	38.1 Å²	38.1	16%	0.162	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-8.5	-175.3	69.2	-97.1	0	0	0	115.4	S109 Y111 F197 N198 E246	S109-F277 WeakPolarHBondContact O-CZ 3.4Å; Y111-F277 HydrophobicContact CD2-CB 3.61Å; Y111-F277 AromaticContact CD2-CD1 3.98Å; Y111-F277 HydrophobicContact CD2-CD1 3.98Å; Y111-F277 AromaticContact CD2-CG 3.86Å; Y111-F277 HydrophobicContact CD2-CG 3.86Å; Y111-F277 HydrophobicContact CE2-CB 4.1Å; Y111-F277 HydrophobicContact CG-CD1 4.49Å; F197-F277 HydrophobicContact CE1-CB 4.12Å; F197-F277 HydrophobicContact CZ-CB 3.82Å; N198-F277 HydrophobicContact CB-CB 4.11Å; N198-F277 PolarHBondContact ND2-O 3.45Å; E246-F277 HydrophobicContact CB-CD1 4.45Å
278	R	96.1	Very high	98.5	Very high	161 Å²	161	39.3 Å²	39.3	61%	0.608	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-1.8	173.5	-57.9	-172.1	-175.7	178.8	3.9	113.8	S109 G276	S109-R278 PolarHBondContact O-NH2 3.28Å; G276-R278 PolarHBondContact O-N 3.23Å
279	G	97.3	Very high	98.5	Very high	22 Å²	22	41.2 Å²	41.2	23%	0.227	20%	0.203	C	C	.	.	S	Bend	trans	91.6	10.9	176.8	0	0	0	0	0	115.2	G276	G276-G279 PolarHBondContact O-N 3.42Å
280	D	97.6	Very high	98.5	Very high	79 Å²	79	41 Å²	41	42%	0.422	20%	0.202	S	C	.	.			trans	-67.5	142.9	165.7	58.7	-68.1	0	0	0	110.6	V275 G276	V275-D280 CarbonylContact C-O 3.57Å; V275-D280 VanDerWaalsContact CA-O 3.24Å; V275-D280 WeakPolarHBondContact CA-O 3.37Å; G276-D280 WeakPolarHBondContact CA-OD1 3.31Å; G276-D280 PolarHBondContact N-O 3.09Å
281	V	98.8	Very high	98.5	Very high	51 Å²	51	45.9 Å²	45.9	31%	0.309	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131.7	-171.4	-171.5	0	0	0	0	110.7	V223 L225 V275	V223-V281 HydrophobicContact CG1-CG2 3.58Å; L225-V281 HydrophobicContact CD2-CG1 3.92Å; L225-V281 HydrophobicContact CD2-CG2 4.45Å; V275-V281 HydrophobicContact CG2-CG1 4.25Å; V275-V281 HydrophobicContact CG2-CG2 4.19Å
282	Q	98.7	Very high	98.4	Very high	102 Å²	102	45.6 Å²	45.6	48%	0.477	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	152.8	170.7	-52.3	-178.4	27.7	0	0	110.1	K273 V274	K273-Q282 CarbonylContact C-O 3.55Å; K273-Q282 WeakPolarHBondContact CA-O 3.46Å; V274-Q282 HydrophobicContact CB-CB 4.33Å; V274-Q282 PolarHBondContact N-O 3.37Å; V274-Q282 PolarHBondContact O-N 3.39Å
283	H	98.9	Very high	98.4	Very high	59 Å²	59	45.6 Å²	45.6	27%	0.273	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	107.8	-177.7	-61.2	-101.4	0	0	0	109.3	D229 G230 W271 K273	D229-H283 WeakPolarHBondContact O-CB 3.38Å; G230-H283 WeakPolarHBondContact CA-CE1 3.02Å; G230-H283 WeakPolarHBondContact CA-ND1 3.38Å; G230-H283 PolarHBondContact N-ND1 2.72Å; W271-H283 HydrophobicContact CE3-CB 4.19Å; W271-H283 HydrophobicContact CZ3-CB 4.3Å; K273-H283 VanDerWaalsContact CD-ND1 3.31Å; K273-H283 WeakPolarHBondContact CD-ND1 3.11Å
284	E	98.8	Very high	98.4	Very high	47 Å²	47	46 Å²	46	22%	0.22	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.8	178.9	-75.8	-161.8	-149.3	0	0	112.1	W271 V272 V274 W286 R289	W271-E284 CarbonylContact C-O 3.56Å; W271-E284 WeakPolarHBondContact CA-O 3.34Å; V272-E284 PolarHBondContact N-O 2.66Å; V272-E284 PolarHBondContact O-N 3.29Å; V274-E284 HydrophobicContact CG2-CG 4Å; E284-W286 PolarHBondContact O-N 3.32Å; E284-W286 PolarHBondContact OE2-NE1 2.74Å; E284-R289 IonicContact OE2-CZ 2.85Å; E284-R289 IonicContact OE2-NH1 2.69Å; E284-R289 PolarHBondContact OE2-NH1 3.18Å; E284-R289 IonicContact OE2-NH2 2.68Å; E284-R289 PolarHBondContact OE2-NH2 2.83Å
285	N	98.8	Very high	98.4	Very high	75 Å²	75	48.6 Å²	48.6	40%	0.401	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	114.2	169.6	-174.4	-31.8	0	0	0	109.9	W271 V287 R289	W271-N285 HydrophobicContact CD2-CB 4.21Å; W271-N285 HydrophobicContact CE3-CB 4.07Å; W271-N285 HydrophobicContact CH2-CB 3.88Å; W271-N285 HydrophobicContact CZ2-CB 4Å; W271-N285 HydrophobicContact CZ3-CB 3.91Å; N285-V287 VanDerWaalsContact OD1-CB 3.27Å; N285-V287 WeakPolarHBondContact OD1-CB 3.41Å; N285-V287 WeakPolarHBondContact OD1-CG2 3.22Å; N285-V287 PolarHBondContact OD1-N 3.23Å; N285-R289 PolarHBondContact O-NH1 3.02Å
286	W	98.8	Very high	98.3	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.008	27%	0.271	C	S	.	.			trans	-106.6	5.9	-179.7	-82.6	41.9	0	0	0	113.5	W240 Y249 E270 V272 E284 P288 R289 Y290 W319 F321 F351	W240-W286 HydrophobicContact CH2-CH2 4.04Å; W240-W286 AromaticContact CH2-CZ3 3.82Å; W240-W286 HydrophobicContact CH2-CZ3 3.82Å; W240-W286 HydrophobicContact CZ2-CE3 4.42Å; W240-W286 HydrophobicContact CZ2-CZ3 4.04Å; Y249-W286 HydrophobicContact CD1-CH2 4.3Å; Y249-W286 AromaticContact CD1-CZ2 3.82Å; Y249-W286 HydrophobicContact CD1-CZ2 3.82Å; Y249-W286 AromaticContact CE1-CZ2 3.95Å; Y249-W286 HydrophobicContact CE1-CZ2 3.95Å; E270-W286 CarbonylContact O-C 3.59Å; E270-W286 VanDerWaalsContact O-CA 3.28Å; E270-W286 WeakPolarHBondContact O-CA 3.4Å; E270-W286 VanDerWaalsContact O-CB 3.27Å; E270-W286 WeakPolarHBondContact O-CB 3.41Å; E270-W286 PolarHBondContact O-N 2.82Å; V272-W286 HydrophobicContact CB-CD2 3.88Å; V272-W286 HydrophobicContact CB-CE3 4.49Å; V272-W286 HydrophobicContact CB-CG 3.93Å; V272-W286 HydrophobicContact CB-CZ2 4.43Å; V272-W286 HydrophobicContact CG1-CD2 4.49Å; V272-W286 HydrophobicContact CG1-CZ2 4.19Å; V272-W286 HydrophobicContact CG2-CB 4.02Å; V272-W286 HydrophobicContact CG2-CD2 3.38Å; V272-W286 HydrophobicContact CG2-CE3 3.59Å; V272-W286 HydrophobicContact CG2-CG 3.57Å; V272-W286 HydrophobicContact CG2-CZ2 4.44Å; V272-W286 HydrophobicContact CG2-CZ3 4.17Å; E284-W286 PolarHBondContact O-N 3.32Å; E284-W286 PolarHBondContact OE2-NE1 2.74Å; W286-P288 VanDerWaalsContact C-N 3.28Å; W286-P288 VanDerWaalsContact O-N 3.14Å; W286-R289 HydrophobicContact CB-CB 4.46Å; W286-R289 VanDerWaalsContact CD2-CD 3.47Å; W286-R289 HydrophobicContact CE3-CB 4.49Å; W286-R289 WeakPolarHBondContact O-CA 3.47Å; W286-R289 WeakPolarHBondContact O-CB 3.39Å; W286-R289 PolarHBondContact O-N 3.28Å; W286-Y290 HydrophobicContact CB-CD2 3.8Å; W286-Y290 HydrophobicContact CB-CE2 3.48Å; W286-Y290 VanDerWaalsContact CB-CE2 3.48Å; W286-Y290 HydrophobicContact CE3-CE2 4.42Å; W286-Y290 VanDerWaalsContact O-CD2 3.24Å; W286-Y290 WeakPolarHBondContact O-CD2 3.28Å; W286-Y290 PolarHBondContact O-N 3.48Å; W286-W319 HydrophobicContact CH2-CD2 4.41Å; W286-W319 HydrophobicContact CH2-CH2 4.16Å; W286-W319 AromaticContact CH2-CZ2 3.91Å; W286-W319 HydrophobicContact CH2-CZ2 3.91Å; W286-W319 HydrophobicContact CH2-CZ3 4.49Å; W286-W319 HydrophobicContact CZ2-CZ2 4.43Å; W286-F321 HydrophobicContact CZ3-CZ 4.07Å; W286-F351 HydrophobicContact CE3-CZ 4.46Å; W286-F351 HydrophobicContact CH2-CZ 4.25Å; W286-F351 AromaticContact CZ3-CZ 3.93Å; W286-F351 HydrophobicContact CZ3-CZ 3.93Å
287	V	98.8	Very high	98.3	Very high	13 Å²	13	51.9 Å²	51.9	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-46.4	-43.7	174.6	178.1	0	0	0	0	112.7	N267 E270 N285 R289 K291	N267-V287 HydrophobicContact CB-CG2 3.95Å; E270-V287 HydrophobicContact CB-CB 4.39Å; E270-V287 HydrophobicContact CB-CG2 3.54Å; E270-V287 HydrophobicContact CG-CG2 4.3Å; E270-V287 PolarHBondContact O-N 3.15Å; N285-V287 VanDerWaalsContact OD1-CB 3.27Å; N285-V287 WeakPolarHBondContact OD1-CB 3.41Å; N285-V287 WeakPolarHBondContact OD1-CG2 3.22Å; N285-V287 PolarHBondContact OD1-N 3.23Å; V287-R289 PolarHBondContact O-N 2.96Å; V287-K291 HydrophobicContact CG1-CD 3.94Å; V287-K291 WeakPolarHBondContact O-CB 3.3Å; V287-K291 VanDerWaalsContact O-CG 3.28Å; V287-K291 WeakPolarHBondContact O-CG 3.39Å; V287-K291 PolarHBondContact O-N 2.96Å; V287-K291 VanDerWaalsContact O-N 3.09Å
288	P	98.6	Very high	98.3	Very high	83 Å²	83	52 Å²	52	54%	0.539	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-35.3	177.1	-20.2	34.4	0	0	0	113.1	W286 S292	W286-P288 VanDerWaalsContact C-N 3.28Å; W286-P288 VanDerWaalsContact O-N 3.14Å; P288-S292 PolarHBondContact O-N 2.97Å; P288-S292 PolarHBondContact O-OG 3.02Å
289	R	98.8	Very high	98.4	Very high	69 Å²	69	44.8 Å²	44.8	26%	0.26	27%	0.265	S	S	.	.	H	α-helix	trans	-71.3	-46.1	-178.4	-63.2	172.3	173.5	117.8	-22.9	111	E284 N285 W286 V287 K291 S292 M293 F351	E284-R289 IonicContact OE2-CZ 2.85Å; E284-R289 IonicContact OE2-NH1 2.69Å; E284-R289 PolarHBondContact OE2-NH1 3.18Å; E284-R289 IonicContact OE2-NH2 2.68Å; E284-R289 PolarHBondContact OE2-NH2 2.83Å; N285-R289 PolarHBondContact O-NH1 3.02Å; W286-R289 HydrophobicContact CB-CB 4.46Å; W286-R289 VanDerWaalsContact CD2-CD 3.47Å; W286-R289 HydrophobicContact CE3-CB 4.49Å; W286-R289 WeakPolarHBondContact O-CA 3.47Å; W286-R289 WeakPolarHBondContact O-CB 3.39Å; W286-R289 PolarHBondContact O-N 3.28Å; V287-R289 PolarHBondContact O-N 2.96Å; R289-K291 VanDerWaalsContact C-N 3.32Å; R289-K291 PolarHBondContact O-N 3.2Å; R289-S292 PolarHBondContact O-N 2.94Å; R289-M293 PolarHBondContact O-N 2.81Å; R289-F351 HydrophobicContact CB-CB 4.47Å; R289-F351 HydrophobicContact CB-CD1 3.83Å; R289-F351 HydrophobicContact CB-CD2 4.24Å; R289-F351 HydrophobicContact CB-CE1 4.05Å; R289-F351 HydrophobicContact CB-CE2 4.46Å; R289-F351 HydrophobicContact CB-CG 3.93Å; R289-F351 HydrophobicContact CB-CZ 4.37Å; R289-F351 HydrophobicContact CG-CB 4.26Å; R289-F351 HydrophobicContact CG-CD1 4.27Å; R289-F351 HydrophobicContact CG-CD2 3.78Å; R289-F351 HydrophobicContact CG-CE2 4.15Å; R289-F351 HydrophobicContact CG-CG 3.85Å
290	Y	98.8	Very high	98.4	Very high	1 Å²	1	50 Å²	50	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-38.8	173.8	-68.1	-64.2	0	0	0	112.1	W240 G254 E270 W286 M293 K294 H307	W240-Y290 WeakPolarHBondContact CZ2-OH 3.41Å; G254-Y290 VanDerWaalsContact CA-CD1 3.44Å; G254-Y290 VanDerWaalsContact CA-CZ 3.42Å; G254-Y290 WeakPolarHBondContact O-CB 3.44Å; G254-Y290 WeakPolarHBondContact O-CD1 3.39Å; E270-Y290 HydrophobicContact CB-CD2 3.85Å; E270-Y290 HydrophobicContact CB-CE2 4.21Å; E270-Y290 HydrophobicContact CG-CD2 4.08Å; W286-Y290 HydrophobicContact CB-CD2 3.8Å; W286-Y290 HydrophobicContact CB-CE2 3.48Å; W286-Y290 VanDerWaalsContact CB-CE2 3.48Å; W286-Y290 HydrophobicContact CE3-CE2 4.42Å; W286-Y290 VanDerWaalsContact O-CD2 3.24Å; W286-Y290 WeakPolarHBondContact O-CD2 3.28Å; W286-Y290 PolarHBondContact O-N 3.48Å; Y290-M293 HydrophobicContact CD1-CE 3.38Å; Y290-M293 HydrophobicContact CE1-CE 3.81Å; Y290-M293 HydrophobicContact CG-CE 4.25Å; Y290-M293 PolarHBondContact O-N 3.19Å; Y290-K294 WeakPolarHBondContact O-CG 3.15Å; Y290-K294 PolarHBondContact O-N 3.16Å; Y290-H307 AromaticContact CD1-CD2 3.75Å; Y290-H307 AromaticContact CD1-NE2 3.83Å; Y290-H307 AromaticContact CE1-CD2 3.82Å
291	K	98.4	Very high	98.2	Very high	102 Å²	102	51 Å²	51	44%	0.443	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-42.4	173	-74.7	174.3	-177.6	175.5	0	113	V287 R289 M293 K294 A295	V287-K291 HydrophobicContact CG1-CD 3.94Å; V287-K291 WeakPolarHBondContact O-CB 3.3Å; V287-K291 VanDerWaalsContact O-CG 3.28Å; V287-K291 WeakPolarHBondContact O-CG 3.39Å; V287-K291 PolarHBondContact O-N 2.96Å; V287-K291 VanDerWaalsContact O-N 3.09Å; R289-K291 VanDerWaalsContact C-N 3.32Å; R289-K291 PolarHBondContact O-N 3.2Å; K291-M293 VanDerWaalsContact C-N 3.3Å; K291-M293 PolarHBondContact O-N 2.84Å; K291-K294 PolarHBondContact O-N 3.45Å; K291-A295 WeakPolarHBondContact O-CB 3.48Å; K291-A295 PolarHBondContact O-N 2.69Å
292	S	98.6	Very high	98.1	Very high	48 Å²	48	52 Å²	52	34%	0.336	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-39.9	174.1	-61.7	0	0	0	0	112	P288 R289 A295 A296	P288-S292 PolarHBondContact O-N 2.97Å; P288-S292 PolarHBondContact O-OG 3.02Å; R289-S292 PolarHBondContact O-N 2.94Å; S292-A295 PolarHBondContact O-N 3.39Å; S292-A296 WeakPolarHBondContact O-CB 3.11Å; S292-A296 PolarHBondContact O-N 2.64Å
293	M	98.8	Very high	98.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-46.4	174.8	-72.9	-169.1	-66.8	0	0	112.6	R289 Y290 K291 A295 A296 A297 F321 L345 F351 I354	R289-M293 PolarHBondContact O-N 2.81Å; Y290-M293 HydrophobicContact CD1-CE 3.38Å; Y290-M293 HydrophobicContact CE1-CE 3.81Å; Y290-M293 HydrophobicContact CG-CE 4.25Å; Y290-M293 PolarHBondContact O-N 3.19Å; K291-M293 VanDerWaalsContact C-N 3.3Å; K291-M293 PolarHBondContact O-N 2.84Å; M293-A295 VanDerWaalsContact C-N 3.35Å; M293-A295 PolarHBondContact O-N 2.98Å; M293-A296 PolarHBondContact O-N 2.99Å; M293-A297 PolarHBondContact O-N 2.95Å; M293-F321 HydrophobicContact CE-CD2 4.36Å; M293-F321 HydrophobicContact CE-CE1 4.36Å; M293-F321 HydrophobicContact CE-CE2 4.15Å; M293-F321 HydrophobicContact CE-CZ 4.16Å; M293-F321 HydrophobicContact SD-CD2 3.43Å; M293-F321 WeakPolarHBondContact SD-CD2 3.49Å; M293-F321 HydrophobicContact SD-CE2 3.54Å; M293-F321 VanDerWaalsContact SD-CE2 3.54Å; M293-F321 HydrophobicContact SD-CG 3.98Å; M293-F321 HydrophobicContact SD-CZ 4.15Å; M293-L345 HydrophobicContact CB-CD1 4.06Å; M293-L345 HydrophobicContact CG-CD1 4.22Å; M293-L345 HydrophobicContact SD-CD1 3.89Å; M293-F351 HydrophobicContact CE-CE1 4.25Å; M293-F351 HydrophobicContact CG-CD1 4.29Å; M293-F351 HydrophobicContact CG-CE1 4.45Å; M293-F351 HydrophobicContact SD-CD1 4.46Å; M293-F351 HydrophobicContact SD-CE1 4.04Å; M293-I354 HydrophobicContact CG-CD1 3.94Å
294	K	98.1	Very high	98.1	Very high	10 Å²	10	44.8 Å²	44.8	4%	0.043	27%	0.269	C	S	.	.	H	α-helix	trans	-55.5	-48.6	174.3	-72.2	-169.3	-73.6	-168.5	0	111.2	E256 Y290 K291 A297 G298 I299 F305	E256-K294 IonicContact OE1-NZ 3.45Å; E256-K294 PolarHBondContact OE1-NZ 3.28Å; E256-K294 IonicContact OE2-NZ 3.63Å; E256-K294 PolarHBondContact OE2-NZ 2.85Å; Y290-K294 WeakPolarHBondContact O-CG 3.15Å; Y290-K294 PolarHBondContact O-N 3.16Å; K291-K294 PolarHBondContact O-N 3.45Å; K294-A297 PolarHBondContact O-N 2.9Å; K294-G298 PolarHBondContact O-N 2.83Å; K294-I299 CarbonylContact C-O 3.57Å; K294-I299 PolarHBondContact O-N 2.85Å; K294-F305 HydrophobicContact CG-CD2 3.87Å; K294-F305 HydrophobicContact CG-CE2 4.48Å
295	A	98.2	Very high	98	Very high	58 Å²	58	42.6 Å²	42.6	48%	0.479	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-44.8	179.1	0	0	0	0	0	113.1	K291 S292 M293 A297 G298	K291-A295 WeakPolarHBondContact O-CB 3.48Å; K291-A295 PolarHBondContact O-N 2.69Å; S292-A295 PolarHBondContact O-N 3.39Å; M293-A295 VanDerWaalsContact C-N 3.35Å; M293-A295 PolarHBondContact O-N 2.98Å; A295-A297 PolarHBondContact O-N 2.87Å; A295-G298 PolarHBondContact O-N 2.67Å
296	A	98.5	Very high	98	Very high	45 Å²	45	39.3 Å²	39.3	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-61.5	-28.4	178.8	0	0	0	0	0	113.3	S292 M293 I354 V356	S292-A296 WeakPolarHBondContact O-CB 3.11Å; S292-A296 PolarHBondContact O-N 2.64Å; M293-A296 PolarHBondContact O-N 2.99Å; A296-I354 HydrophobicContact CB-CB 3.67Å; A296-I354 HydrophobicContact CB-CD1 4.38Å; A296-I354 HydrophobicContact CB-CG2 3.49Å; A296-I354 VanDerWaalsContact CB-CG2 3.49Å; A296-V356 HydrophobicContact CB-CG2 4.14Å; A296-V356 WeakPolarHBondContact O-CG2 3.25Å
297	A	98	Very high	98.1	Very high	26 Å²	26	39.3 Å²	39.3	22%	0.215	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	0.3	175.1	0	0	0	0	0	114.3	M293 K294 A295 I299 F305 V356	M293-A297 PolarHBondContact O-N 2.95Å; K294-A297 PolarHBondContact O-N 2.9Å; A295-A297 PolarHBondContact O-N 2.87Å; A297-I299 VanDerWaalsContact C-N 3.34Å; A297-I299 HydrophobicContact CB-CD1 4.2Å; A297-I299 HydrophobicContact CB-CG1 4.13Å; A297-F305 HydrophobicContact CB-CE2 3.84Å; A297-F305 HydrophobicContact CB-CZ 3.46Å; A297-F305 VanDerWaalsContact CB-CZ 3.46Å; A297-V356 HydrophobicContact CB-CG1 4.47Å; A297-V356 HydrophobicContact CB-CG2 4.39Å
298	G	98.1	Very high	98.1	Very high	40 Å²	40	39.6 Å²	39.6	41%	0.412	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	38.2	-174.7	0	0	0	0	0	112.8	K294 A295 K328	K294-G298 PolarHBondContact O-N 2.83Å; A295-G298 PolarHBondContact O-N 2.67Å; G298-K328 WeakPolarHBondContact O-CE 3.47Å; G298-K328 PolarHBondContact O-NZ 2.82Å
299	I	98.2	Very high	98.1	Very high	9 Å²	9	35.6 Å²	35.6	5%	0.046	22%	0.216	C	C	.	.			trans	-108.2	107.2	174.4	-59.6	-179	0	0	0	108.3	K294 A297 G303 F305 A326 S327	K294-I299 CarbonylContact C-O 3.57Å; K294-I299 PolarHBondContact O-N 2.85Å; A297-I299 VanDerWaalsContact C-N 3.34Å; A297-I299 HydrophobicContact CB-CD1 4.2Å; A297-I299 HydrophobicContact CB-CG1 4.13Å; I299-G303 VanDerWaalsContact CG2-C 3.45Å; I299-F305 HydrophobicContact CD1-CD1 4.17Å; I299-F305 HydrophobicContact CD1-CD2 4.47Å; I299-F305 HydrophobicContact CD1-CE1 3.69Å; I299-F305 HydrophobicContact CD1-CE2 4.02Å; I299-F305 HydrophobicContact CD1-CZ 3.61Å; I299-A326 HydrophobicContact CD1-CB 4.3Å; I299-S327 VanDerWaalsContact CG2-O 3.29Å; I299-S327 WeakPolarHBondContact CG2-O 3.44Å
300	E	95.6	Very high	98.1	Very high	131 Å²	131	32.4 Å²	32.4	61%	0.612	20%	0.204	S	C	*	.			trans	-96.3	151.6	174.8	-65.6	-59	151.7	0	0	111	G303	E300-G303 WeakPolarHBondContact O-CA 3.19Å; E300-G303 PolarHBondContact O-N 3.46Å
301	P	94.6	Very high	98.1	Very high	99 Å²	99	32.8 Å²	32.8	64%	0.643	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	137.4	171.3	-25.2	35	0	0	0	111.9
302	P	96.1	Very high	98.1	Very high	73 Å²	73	28.8 Å²	28.8	47%	0.474	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	cis	-87.5	10.9	12.5	37.5	-38.6	0	0	0	115.1	R330	P302-R330 HydrophobicContact CB-CB 3.91Å; P302-R330 HydrophobicContact CB-CG 4.29Å; P302-R330 HydrophobicContact CG-CB 4.02Å
303	G	98.1	Very high	98.1	Very high	3 Å²	3	26.5 Å²	26.5	3%	0.031	17%	0.173	C	C	.	.			trans	-62.9	157.4	173.3	0	0	0	0	0	113.6	I299 E300 S327	I299-G303 VanDerWaalsContact CG2-C 3.45Å; E300-G303 WeakPolarHBondContact O-CA 3.19Å; E300-G303 PolarHBondContact O-N 3.46Å; G303-S327 CarbonylContact C-O 3.52Å; G303-S327 WeakPolarHBondContact CA-O 3.03Å
304	Y	98.7	Very high	98.1	Very high	7 Å²	7	31 Å²	31	3%	0.027	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	163.6	-169.7	62.3	-83.4	0	0	0	113	K255 I306 S327 E329 Y331 D336	K255-Y304 HydrophobicContact CD-CD2 3.88Å; K255-Y304 HydrophobicContact CD-CG 4.19Å; Y304-I306 HydrophobicContact CD2-CG1 4.08Å; Y304-I306 HydrophobicContact CE2-CD1 4.26Å; Y304-I306 HydrophobicContact CE2-CG1 4.19Å; Y304-S327 VanDerWaalsContact CE1-CB 3.46Å; Y304-S327 PolarHBondContact N-O 3.07Å; Y304-S327 PolarHBondContact O-N 3.38Å; Y304-E329 WeakPolarHBondContact CD1-O 3.29Å; Y304-E329 VanDerWaalsContact CE1-O 3.28Å; Y304-E329 WeakPolarHBondContact CE1-O 3.33Å; Y304-Y331 HydrophobicContact CE1-CD2 4.4Å; Y304-Y331 VanDerWaalsContact CE1-N 3.29Å; Y304-Y331 AromaticContact CE2-CD2 3.93Å; Y304-Y331 HydrophobicContact CE2-CD2 3.93Å; Y304-Y331 AromaticContact CZ-CD2 3.81Å; Y304-D336 WeakPolarHBondContact CE2-OD1 3.26Å; Y304-D336 PolarHBondContact OH-OD1 2.85Å
305	F	98.7	Very high	98.1	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	158.9	157.1	-76.8	-60.2	0	0	0	109.3	K255 K294 A297 I299 H307 P323 R325 A326 L343 L345	K255-F305 WeakPolarHBondContact CB-O 3.39Å; K294-F305 HydrophobicContact CG-CD2 3.87Å; K294-F305 HydrophobicContact CG-CE2 4.48Å; A297-F305 HydrophobicContact CB-CE2 3.84Å; A297-F305 HydrophobicContact CB-CZ 3.46Å; A297-F305 VanDerWaalsContact CB-CZ 3.46Å; I299-F305 HydrophobicContact CD1-CD1 4.17Å; I299-F305 HydrophobicContact CD1-CD2 4.47Å; I299-F305 HydrophobicContact CD1-CE1 3.69Å; I299-F305 HydrophobicContact CD1-CE2 4.02Å; I299-F305 HydrophobicContact CD1-CZ 3.61Å; F305-H307 WeakPolarHBondContact CB-NE2 3.36Å; F305-H307 AromaticContact CD2-NE2 3.95Å; F305-H307 AromaticContact CG-NE2 3.91Å; F305-P323 HydrophobicContact CB-CB 4.44Å; F305-P323 HydrophobicContact CD1-CB 3.65Å; F305-P323 HydrophobicContact CD1-CG 3.7Å; F305-P323 HydrophobicContact CE1-CB 4.19Å; F305-P323 HydrophobicContact CE1-CG 3.84Å; F305-P323 HydrophobicContact CG-CB 4.31Å; F305-P323 HydrophobicContact CG-CG 4.29Å; F305-R325 WeakPolarHBondContact CA-O 3.49Å; F305-A326 HydrophobicContact CD1-CB 3.65Å; F305-A326 HydrophobicContact CE1-CB 3.55Å; F305-L343 HydrophobicContact CE1-CD1 3.75Å; F305-L343 HydrophobicContact CZ-CD1 4.11Å; F305-L345 HydrophobicContact CE2-CD1 4.01Å; F305-L345 HydrophobicContact CZ-CD1 4.12Å; F305-L345 HydrophobicContact CZ-CD2 4.27Å
306	I	98.8	Very high	98.1	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.036	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.3	154.1	-67.9	179.2	0	0	0	107.3	L253 K255 Y304 E308 P323 R324 R325 Y331 D336	L253-I306 HydrophobicContact CB-CG2 4.45Å; L253-I306 HydrophobicContact CD2-CG2 3.54Å; L253-I306 WeakPolarHBondContact O-CA 3.13Å; K255-I306 HydrophobicContact CD-CD1 4.46Å; K255-I306 HydrophobicContact CD-CG1 3.88Å; K255-I306 HydrophobicContact CG-CG1 4.47Å; Y304-I306 HydrophobicContact CD2-CG1 4.08Å; Y304-I306 HydrophobicContact CE2-CD1 4.26Å; Y304-I306 HydrophobicContact CE2-CG1 4.19Å; I306-E308 HydrophobicContact CG2-CG 4.15Å; I306-P323 CarbonylContact O-C 3.09Å; I306-P323 VanDerWaalsContact O-CA 3.32Å; I306-P323 WeakPolarHBondContact O-CA 3.48Å; I306-P323 WeakPolarHBondContact O-CB 3.39Å; I306-R324 HydrophobicContact CG2-CB 4.31Å; I306-R324 PolarHBondContact O-N 2.92Å; I306-R325 HydrophobicContact CB-CB 3.98Å; I306-R325 HydrophobicContact CB-CG 4.12Å; I306-R325 HydrophobicContact CD1-CB 4.39Å; I306-R325 HydrophobicContact CD1-CG 4.14Å; I306-R325 HydrophobicContact CG1-CB 4.3Å; I306-R325 HydrophobicContact CG1-CG 4.48Å; I306-R325 PolarHBondContact N-O 3.48Å; I306-R325 PolarHBondContact O-N 3.38Å; I306-Y331 HydrophobicContact CD1-CE2 4.24Å; I306-D336 VanDerWaalsContact CD1-OD2 3.31Å; I306-D336 WeakPolarHBondContact CD1-OD2 3.42Å
307	H	98.9	Very high	98.2	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.1	179.9	-65.3	-91.9	0	0	0	110.2	L253 Y290 F305 F321	L253-H307 PolarHBondContact O-N 3.48Å; Y290-H307 AromaticContact CD1-CD2 3.75Å; Y290-H307 AromaticContact CD1-NE2 3.83Å; Y290-H307 AromaticContact CE1-CD2 3.82Å; F305-H307 WeakPolarHBondContact CB-NE2 3.36Å; F305-H307 AromaticContact CD2-NE2 3.95Å; F305-H307 AromaticContact CG-NE2 3.91Å; H307-F321 AromaticContact ND1-CD1 3.72Å
308	E	98.9	Very high	98.2	Very high	19 Å²	19	37.4 Å²	37.4	9%	0.089	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	14.8	171.6	-58.8	-179.5	172.1	0	0	110.7	E239 I306 R324 S369	E239-E308 HydrophobicContact CB-CB 4.39Å; E239-E308 HydrophobicContact CB-CG 4.1Å; E239-E308 CarbonylContact O-C 3.53Å; E239-E308 VanDerWaalsContact O-C 3.24Å; E239-E308 WeakPolarHBondContact O-CA 3.38Å; I306-E308 HydrophobicContact CG2-CG 4.15Å; E308-R324 HydrophobicContact CB-CB 4.46Å; E308-R324 VanDerWaalsContact CD-CD 3.42Å; E308-R324 HydrophobicContact CG-CB 4.11Å; E308-R324 VanDerWaalsContact OE1-CD 3.27Å; E308-R324 WeakPolarHBondContact OE1-CD 3.31Å; E308-R324 IonicContact OE1-NE 3.29Å; E308-R324 WeakPolarHBondContact OE2-CD 3.39Å; E308-R324 IonicContact OE2-CZ 2.63Å; E308-R324 VanDerWaalsContact OE2-CZ 3.31Å; E308-R324 IonicContact OE2-NE 3.54Å; E308-R324 PolarHBondContact OE2-NE 2.92Å; E308-R324 IonicContact OE2-NH1 2.85Å; E308-R324 PolarHBondContact OE2-NH1 2.91Å; E308-S369 CarbonylContact O-C 3.47Å
309	S	98.9	Very high	98.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	137.6	172.9	72.7	0	0	0	0	111.9	L322 F371	S309-L322 WeakPolarHBondContact OG-CB 3.42Å; S309-L322 PolarHBondContact OG-N 2.61Å; S309-L322 PolarHBondContact OG-O 2.93Å; S309-F371 WeakPolarHBondContact OG-CD1 3.31Å
310	A	98.9	Very high	98.3	Very high	2 Å²	2	35.7 Å²	35.7	2%	0.017	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	149.8	174.2	0	0	0	0	0	109.7	W240 W319 F320 F321	W240-A310 HydrophobicContact CD2-CB 3.65Å; W240-A310 HydrophobicContact CE3-CB 3.55Å; W240-A310 HydrophobicContact CG-CB 4.16Å; W240-A310 HydrophobicContact CH2-CB 4.33Å; W240-A310 HydrophobicContact CZ2-CB 4.41Å; W240-A310 HydrophobicContact CZ3-CB 3.92Å; A310-W319 HydrophobicContact CB-CZ3 4.47Å; A310-F320 CarbonylContact C-O 3.54Å; A310-F320 VanDerWaalsContact CA-O 3.27Å; A310-F320 WeakPolarHBondContact CA-O 3.15Å; A310-F321 HydrophobicContact CB-CD1 3.57Å; A310-F321 HydrophobicContact CB-CE1 3.45Å; A310-F321 VanDerWaalsContact CB-CE1 3.45Å; A310-F321 HydrophobicContact CB-CG 4.5Å; A310-F321 HydrophobicContact CB-CZ 4.29Å
311	A	98.9	Very high	98.4	Very high	8 Å²	8	29.4 Å²	29.4	7%	0.066	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	146	166.5	0	0	0	0	0	109.5	W319 F320 F371 F373	A311-W319 CarbonylContact O-C 3.44Å; A311-W319 WeakPolarHBondContact O-CA 3.47Å; A311-F320 PolarHBondContact N-O 2.89Å; A311-F320 PolarHBondContact O-N 2.71Å; A311-F371 HydrophobicContact CB-CD2 4.42Å; A311-F371 HydrophobicContact CB-CE1 4.47Å; A311-F371 HydrophobicContact CB-CE2 3.52Å; A311-F371 HydrophobicContact CB-CZ 3.53Å; A311-F373 HydrophobicContact CB-CD2 4.24Å; A311-F373 HydrophobicContact CB-CE2 3.9Å
312	W	98.9	Very high	98.6	Very high	18 Å²	18	24.7 Å²	24.7	7%	0.068	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	141	163.5	166.1	-99.2	0	0	0	108.6	K244 D314 Q317 R318 W319 P349	K244-W312 HydrophobicContact CB-CB 3.92Å; K244-W312 HydrophobicContact CB-CD2 4.3Å; K244-W312 HydrophobicContact CB-CG 3.67Å; K244-W312 HydrophobicContact CD-CD2 3.59Å; K244-W312 HydrophobicContact CD-CE3 3.83Å; K244-W312 HydrophobicContact CD-CG 3.88Å; K244-W312 HydrophobicContact CD-CZ2 4.38Å; K244-W312 HydrophobicContact CD-CZ3 4.34Å; K244-W312 HydrophobicContact CG-CB 4.42Å; K244-W312 HydrophobicContact CG-CD2 3.81Å; K244-W312 HydrophobicContact CG-CG 3.7Å; W312-D314 VanDerWaalsContact NE1-CG 3.29Å; W312-D314 PolarHBondContact NE1-OD1 2.85Å; W312-Q317 HydrophobicContact CH2-CB 4.25Å; W312-R318 VanDerWaalsContact CE3-C 3.4Å; W312-W319 HydrophobicContact CB-CD2 4.25Å; W312-W319 HydrophobicContact CB-CE3 4.09Å; W312-W319 HydrophobicContact CB-CH2 4.14Å; W312-W319 HydrophobicContact CB-CZ2 4.3Å; W312-W319 HydrophobicContact CB-CZ3 4.05Å; W312-W319 AromaticContact CE3-CD1 3.7Å; W312-W319 HydrophobicContact CE3-CD2 4.17Å; W312-W319 AromaticContact CE3-CG 3.97Å; W312-W319 HydrophobicContact CE3-CG 3.97Å; W312-W319 AromaticContact CE3-NE1 3.72Å; W312-W319 AromaticContact CZ3-CD1 3.99Å; W312-P349 HydrophobicContact CH2-CB 4.23Å; W312-P349 HydrophobicContact CH2-CG 3.77Å; W312-P349 HydrophobicContact CZ3-CB 4.14Å; W312-P349 HydrophobicContact CZ3-CG 3.91Å
313	S	98.9	Very high	98.8	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.1	173	164.2	0	0	0	0	108.9	T315 L316 Q317 R318 D379	S313-T315 VanDerWaalsContact C-N 3.32Å; S313-T315 PolarHBondContact OG-N 3.43Å; S313-L316 VanDerWaalsContact OG-CB 3.31Å; S313-L316 WeakPolarHBondContact OG-CB 3.26Å; S313-L316 WeakPolarHBondContact OG-CG 3.28Å; S313-L316 PolarHBondContact OG-N 2.91Å; S313-Q317 VanDerWaalsContact O-CA 3.26Å; S313-Q317 WeakPolarHBondContact O-CA 3.38Å; S313-Q317 PolarHBondContact O-N 2.73Å; S313-R318 PolarHBondContact N-O 3.15Å; S313-R318 PolarHBondContact O-N 3.41Å; S313-D379 WeakPolarHBondContact CB-OD2 3.27Å; S313-D379 WeakPolarHBondContact OG-CB 3.38Å; S313-D379 PolarHBondContact OG-OD2 3.2Å
314	D	98.4	Very high	98.8	Very high	94 Å²	94	21.3 Å²	21.3	50%	0.503	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-35.3	171	-75.7	-55.8	0	0	0	111.6	W312 L316 Q317	W312-D314 VanDerWaalsContact NE1-CG 3.29Å; W312-D314 PolarHBondContact NE1-OD1 2.85Å; D314-L316 VanDerWaalsContact C-N 3.35Å; D314-L316 PolarHBondContact O-N 2.69Å; D314-Q317 PolarHBondContact O-NE2 3.22Å
315	T	98.5	Very high	98.8	Very high	86 Å²	86	21.1 Å²	21.1	53%	0.528	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-43.8	177.8	-43.8	0	0	0	0	111.9	S313 D378 D379	S313-T315 VanDerWaalsContact C-N 3.32Å; S313-T315 PolarHBondContact OG-N 3.43Å; T315-D378 HydrophobicContact CG2-CB 4.33Å; T315-D379 WeakPolarHBondContact CB-OD2 3.06Å; T315-D379 PolarHBondContact OG1-OD2 2.81Å
316	L	98.6	Very high	98.8	Very high	55 Å²	55	22.1 Å²	22.1	29%	0.288	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-9	-174.5	-57.1	175.4	0	0	0	112.9	S313 D314 R318 F320 D379 L403	S313-L316 VanDerWaalsContact OG-CB 3.31Å; S313-L316 WeakPolarHBondContact OG-CB 3.26Å; S313-L316 WeakPolarHBondContact OG-CG 3.28Å; S313-L316 PolarHBondContact OG-N 2.91Å; D314-L316 VanDerWaalsContact C-N 3.35Å; D314-L316 PolarHBondContact O-N 2.69Å; L316-R318 VanDerWaalsContact C-N 3.33Å; L316-R318 WeakPolarHBondContact O-CG 3.19Å; L316-R318 PolarHBondContact O-N 3.48Å; L316-F320 HydrophobicContact CB-CE2 4.32Å; L316-F320 HydrophobicContact CD1-CE2 3.93Å; L316-F320 HydrophobicContact CD1-CZ 3.63Å; L316-D379 HydrophobicContact CD1-CB 3.92Å; L316-D379 HydrophobicContact CG-CB 4.22Å; L316-L403 HydrophobicContact CD1-CD1 3.63Å
317	Q	98.8	Very high	98.8	Very high	100 Å²	100	22 Å²	22	47%	0.467	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	45.6	-174.8	-69.1	-68.1	-55.6	0	0	112.7	W312 S313 D314 P349	W312-Q317 HydrophobicContact CH2-CB 4.25Å; S313-Q317 VanDerWaalsContact O-CA 3.26Å; S313-Q317 WeakPolarHBondContact O-CA 3.38Å; S313-Q317 PolarHBondContact O-N 2.73Å; D314-Q317 PolarHBondContact O-NE2 3.22Å; Q317-P349 WeakPolarHBondContact O-CD 3.35Å; Q317-P349 WeakPolarHBondContact O-CG 3.27Å
318	R	98.9	Very high	98.7	Very high	32 Å²	32	29.1 Å²	29.1	12%	0.121	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.2	-173.8	-70.3	179.6	88.3	83.5	-1.3	112.9	W312 S313 L316 F320 S346 C347 D353	W312-R318 VanDerWaalsContact CE3-C 3.4Å; S313-R318 PolarHBondContact N-O 3.15Å; S313-R318 PolarHBondContact O-N 3.41Å; L316-R318 VanDerWaalsContact C-N 3.33Å; L316-R318 WeakPolarHBondContact O-CG 3.19Å; L316-R318 PolarHBondContact O-N 3.48Å; R318-F320 HydrophobicContact CB-CD2 4.24Å; R318-F320 HydrophobicContact CB-CE2 3.67Å; R318-F320 HydrophobicContact CB-CZ 4.3Å; R318-S346 WeakPolarHBondContact CD-OG 3.33Å; R318-S346 PolarHBondContact NE-OG 2.63Å; R318-S346 PolarHBondContact NH2-O 3.23Å; R318-C347 CarbonylContact C-O 3.57Å; R318-C347 VanDerWaalsContact CA-O 3.28Å; R318-C347 WeakPolarHBondContact CA-O 3.36Å; R318-C347 VanDerWaalsContact CB-O 3.31Å; R318-C347 WeakPolarHBondContact CB-O 3.4Å; R318-D353 IonicContact CZ-OD2 3.37Å; R318-D353 IonicContact NH1-OD2 3.41Å; R318-D353 PolarHBondContact NH1-OD2 3.4Å; R318-D353 PolarHBondContact NH2-O 3.35Å; R318-D353 IonicContact NH2-OD2 3.81Å; R318-D353 PolarHBondContact NH2-OD2 2.9Å
319	W	98.9	Very high	98.7	Very high	6 Å²	6	33.5 Å²	33.5	2%	0.023	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.3	163.6	-76.4	99.6	0	0	0	110.1	W240 A242 K244 Y249 W286 A310 A311 W312 F321 S346 C347 F351	W240-W319 HydrophobicContact CZ3-CZ3 4.41Å; A242-W319 HydrophobicContact CB-CH2 4.07Å; A242-W319 HydrophobicContact CB-CZ3 3.59Å; K244-W319 HydrophobicContact CB-CH2 4.45Å; K244-W319 HydrophobicContact CB-CZ2 4.23Å; K244-W319 HydrophobicContact CD-CZ2 3.67Å; Y249-W319 HydrophobicContact CD1-CH2 4.08Å; Y249-W319 HydrophobicContact CD1-CZ2 4.11Å; Y249-W319 HydrophobicContact CD2-CH2 4.07Å; Y249-W319 HydrophobicContact CD2-CZ2 4.31Å; Y249-W319 HydrophobicContact CE1-CZ2 4.31Å; Y249-W319 HydrophobicContact CE2-CZ2 4.49Å; Y249-W319 AromaticContact CG-CH2 3.75Å; Y249-W319 HydrophobicContact CG-CH2 3.75Å; Y249-W319 HydrophobicContact CG-CZ2 4.13Å; W286-W319 HydrophobicContact CH2-CD2 4.41Å; W286-W319 HydrophobicContact CH2-CH2 4.16Å; W286-W319 AromaticContact CH2-CZ2 3.91Å; W286-W319 HydrophobicContact CH2-CZ2 3.91Å; W286-W319 HydrophobicContact CH2-CZ3 4.49Å; W286-W319 HydrophobicContact CZ2-CZ2 4.43Å; A310-W319 HydrophobicContact CB-CZ3 4.47Å; A311-W319 CarbonylContact O-C 3.44Å; A311-W319 WeakPolarHBondContact O-CA 3.47Å; W312-W319 HydrophobicContact CB-CD2 4.25Å; W312-W319 HydrophobicContact CB-CE3 4.09Å; W312-W319 HydrophobicContact CB-CH2 4.14Å; W312-W319 HydrophobicContact CB-CZ2 4.3Å; W312-W319 HydrophobicContact CB-CZ3 4.05Å; W312-W319 AromaticContact CE3-CD1 3.7Å; W312-W319 HydrophobicContact CE3-CD2 4.17Å; W312-W319 AromaticContact CE3-CG 3.97Å; W312-W319 HydrophobicContact CE3-CG 3.97Å; W312-W319 AromaticContact CE3-NE1 3.72Å; W312-W319 AromaticContact CZ3-CD1 3.99Å; W319-F321 HydrophobicContact CB-CE2 3.76Å; W319-F321 HydrophobicContact CB-CZ 4.31Å; W319-F321 HydrophobicContact CE3-CZ 4.31Å; W319-S346 CarbonylContact O-C 3.56Å; W319-S346 WeakPolarHBondContact O-CA 3.31Å; W319-C347 HydrophobicContact CB-CB 4.2Å; W319-C347 PolarHBondContact N-O 2.79Å; W319-C347 PolarHBondContact O-N 2.94Å; W319-F351 HydrophobicContact CB-CZ 4.12Å; W319-F351 AromaticContact CD1-CE2 3.64Å; W319-F351 AromaticContact CD1-CZ 3.84Å; W319-F351 HydrophobicContact CG-CE2 4.2Å; W319-F351 AromaticContact CG-CZ 3.92Å; W319-F351 HydrophobicContact CG-CZ 3.92Å
320	F	98.9	Very high	98.7	Very high	7 Å²	7	40.1 Å²	40.1	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.8	174.2	-71.2	-100.2	0	0	0	109.8	A310 A311 L316 R318 V344 L345 S346 F371 F373 L403	A310-F320 CarbonylContact C-O 3.54Å; A310-F320 VanDerWaalsContact CA-O 3.27Å; A310-F320 WeakPolarHBondContact CA-O 3.15Å; A311-F320 PolarHBondContact N-O 2.89Å; A311-F320 PolarHBondContact O-N 2.71Å; L316-F320 HydrophobicContact CB-CE2 4.32Å; L316-F320 HydrophobicContact CD1-CE2 3.93Å; L316-F320 HydrophobicContact CD1-CZ 3.63Å; R318-F320 HydrophobicContact CB-CD2 4.24Å; R318-F320 HydrophobicContact CB-CE2 3.67Å; R318-F320 HydrophobicContact CB-CZ 4.3Å; F320-V344 HydrophobicContact CD1-CG1 4.46Å; F320-L345 CarbonylContact C-O 3.58Å; F320-L345 VanDerWaalsContact CA-O 3.25Å; F320-L345 WeakPolarHBondContact CA-O 3.46Å; F320-S346 VanDerWaalsContact CE1-CB 3.5Å; F320-S346 WeakPolarHBondContact CE1-OG 3.37Å; F320-S346 WeakPolarHBondContact CZ-OG 3.18Å; F320-F371 HydrophobicContact CB-CE2 4.17Å; F320-F371 HydrophobicContact CB-CZ 3.76Å; F320-F373 HydrophobicContact CB-CZ 4.17Å; F320-F373 HydrophobicContact CD1-CZ 4.2Å; F320-F373 HydrophobicContact CD2-CE2 4.04Å; F320-F373 AromaticContact CD2-CZ 3.55Å; F320-F373 HydrophobicContact CD2-CZ 3.55Å; F320-F373 HydrophobicContact CE1-CZ 4.47Å; F320-F373 AromaticContact CE2-CZ 3.87Å; F320-F373 HydrophobicContact CE2-CZ 3.87Å; F320-F373 HydrophobicContact CG-CE2 4.43Å; F320-F373 AromaticContact CG-CZ 3.72Å; F320-F373 HydrophobicContact CG-CZ 3.72Å; F320-F373 HydrophobicContact CZ-CZ 4.32Å; F320-L403 HydrophobicContact CD1-CD2 4.17Å; F320-L403 HydrophobicContact CE1-CD1 4.1Å; F320-L403 HydrophobicContact CE1-CD2 3.7Å; F320-L403 HydrophobicContact CZ-CD1 4.13Å; F320-L403 HydrophobicContact CZ-CD2 4.45Å
321	F	98.9	Very high	98.6	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	139	174.9	-57	-96.8	0	0	0	110	W240 W286 M293 H307 A310 W319 L345 F351	W240-F321 HydrophobicContact CZ2-CE1 4.3Å; W286-F321 HydrophobicContact CZ3-CZ 4.07Å; M293-F321 HydrophobicContact CE-CD2 4.36Å; M293-F321 HydrophobicContact CE-CE1 4.36Å; M293-F321 HydrophobicContact CE-CE2 4.15Å; M293-F321 HydrophobicContact CE-CZ 4.16Å; M293-F321 HydrophobicContact SD-CD2 3.43Å; M293-F321 WeakPolarHBondContact SD-CD2 3.49Å; M293-F321 HydrophobicContact SD-CE2 3.54Å; M293-F321 VanDerWaalsContact SD-CE2 3.54Å; M293-F321 HydrophobicContact SD-CG 3.98Å; M293-F321 HydrophobicContact SD-CZ 4.15Å; H307-F321 AromaticContact ND1-CD1 3.72Å; A310-F321 HydrophobicContact CB-CD1 3.57Å; A310-F321 HydrophobicContact CB-CE1 3.45Å; A310-F321 VanDerWaalsContact CB-CE1 3.45Å; A310-F321 HydrophobicContact CB-CG 4.5Å; A310-F321 HydrophobicContact CB-CZ 4.29Å; W319-F321 HydrophobicContact CB-CE2 3.76Å; W319-F321 HydrophobicContact CB-CZ 4.31Å; W319-F321 HydrophobicContact CE3-CZ 4.31Å; F321-L345 HydrophobicContact CB-CB 4.24Å; F321-L345 HydrophobicContact CB-CD1 4.37Å; F321-L345 PolarHBondContact N-O 2.93Å; F321-L345 PolarHBondContact O-N 3.42Å; F321-F351 AromaticContact CE2-CE1 3.73Å; F321-F351 HydrophobicContact CE2-CE1 3.73Å; F321-F351 HydrophobicContact CE2-CZ 4.01Å; F321-F351 HydrophobicContact CZ-CE1 4.02Å; F321-F351 HydrophobicContact CZ-CZ 4.02Å
322	L	98.9	Very high	98.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	94.7	164.8	-55	179.6	0	0	0	107.1	S309 R324 V344 F368 F371 I382 A384 F401	S309-L322 WeakPolarHBondContact OG-CB 3.42Å; S309-L322 PolarHBondContact OG-N 2.61Å; S309-L322 PolarHBondContact OG-O 2.93Å; L322-R324 PolarHBondContact O-N 3.36Å; L322-V344 HydrophobicContact CD2-CB 3.91Å; L322-V344 HydrophobicContact CD2-CG1 3.73Å; L322-V344 HydrophobicContact CD2-CG2 3.58Å; L322-F368 HydrophobicContact CB-CB 3.69Å; L322-F368 HydrophobicContact CB-CD1 4.22Å; L322-F368 HydrophobicContact CB-CD2 3.68Å; L322-F368 HydrophobicContact CB-CE2 4.27Å; L322-F368 HydrophobicContact CB-CG 3.62Å; L322-F368 HydrophobicContact CD1-CD1 3.78Å; L322-F368 HydrophobicContact CD1-CD2 4.43Å; L322-F368 HydrophobicContact CD1-CE1 3.89Å; L322-F368 HydrophobicContact CD1-CE2 4.48Å; L322-F368 HydrophobicContact CD1-CG 4.07Å; L322-F368 HydrophobicContact CD1-CZ 4.23Å; L322-F368 HydrophobicContact CD2-CE2 4.44Å; L322-F368 HydrophobicContact CG-CD2 4.49Å; L322-F368 HydrophobicContact CG-CG 4.44Å; L322-F371 HydrophobicContact CB-CD1 4.1Å; L322-F371 HydrophobicContact CB-CE1 4.36Å; L322-F371 HydrophobicContact CD1-CB 3.7Å; L322-F371 HydrophobicContact CD1-CD1 3.57Å; L322-F371 HydrophobicContact CD1-CD2 4.35Å; L322-F371 HydrophobicContact CD1-CE1 4.3Å; L322-F371 HydrophobicContact CD1-CG 3.61Å; L322-F371 HydrophobicContact CG-CD1 3.6Å; L322-F371 HydrophobicContact CG-CE1 3.86Å; L322-F371 HydrophobicContact CG-CG 4.09Å; L322-I382 HydrophobicContact CD1-CG2 4.41Å; L322-A384 HydrophobicContact CD1-CB 3.93Å; L322-F401 HydrophobicContact CD1-CZ 3.86Å; L322-F401 HydrophobicContact CD2-CZ 4.47Å
323	P	98.8	Very high	98.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139.8	-179.3	-21.2	32.7	0	0	0	110.7	F305 I306 T341 L345	F305-P323 HydrophobicContact CB-CB 4.44Å; F305-P323 HydrophobicContact CD1-CB 3.65Å; F305-P323 HydrophobicContact CD1-CG 3.7Å; F305-P323 HydrophobicContact CE1-CB 4.19Å; F305-P323 HydrophobicContact CE1-CG 3.84Å; F305-P323 HydrophobicContact CG-CB 4.31Å; F305-P323 HydrophobicContact CG-CG 4.29Å; I306-P323 CarbonylContact O-C 3.09Å; I306-P323 VanDerWaalsContact O-CA 3.32Å; I306-P323 WeakPolarHBondContact O-CA 3.48Å; I306-P323 WeakPolarHBondContact O-CB 3.39Å; P323-T341 HydrophobicContact CB-CG2 4.13Å; P323-T341 WeakPolarHBondContact O-CG2 3.39Å; P323-L345 HydrophobicContact CG-CD1 3.92Å; P323-L345 HydrophobicContact CG-CG 4.32Å
324	R	98.8	Very high	98.1	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.015	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	-52.3	169.8	-175.5	-163.6	-156.6	51	4.6	109.4	I306 E308 L322 G340 T341 G367 F368 S387 E389	I306-R324 HydrophobicContact CG2-CB 4.31Å; I306-R324 PolarHBondContact O-N 2.92Å; E308-R324 HydrophobicContact CB-CB 4.46Å; E308-R324 VanDerWaalsContact CD-CD 3.42Å; E308-R324 HydrophobicContact CG-CB 4.11Å; E308-R324 VanDerWaalsContact OE1-CD 3.27Å; E308-R324 WeakPolarHBondContact OE1-CD 3.31Å; E308-R324 IonicContact OE1-NE 3.29Å; E308-R324 WeakPolarHBondContact OE2-CD 3.39Å; E308-R324 IonicContact OE2-CZ 2.63Å; E308-R324 VanDerWaalsContact OE2-CZ 3.31Å; E308-R324 IonicContact OE2-NE 3.54Å; E308-R324 PolarHBondContact OE2-NE 2.92Å; E308-R324 IonicContact OE2-NH1 2.85Å; E308-R324 PolarHBondContact OE2-NH1 2.91Å; L322-R324 PolarHBondContact O-N 3.36Å; R324-G340 WeakPolarHBondContact O-CA 3.31Å; R324-T341 PolarHBondContact O-N 2.92Å; R324-G367 VanDerWaalsContact O-CA 3.26Å; R324-G367 WeakPolarHBondContact O-CA 3.13Å; R324-F368 VanDerWaalsContact CA-O 3.32Å; R324-F368 WeakPolarHBondContact CA-O 3.27Å; R324-F368 WeakPolarHBondContact CB-O 3.28Å; R324-S387 PolarHBondContact NH1-OG 3.3Å; R324-S387 PolarHBondContact NH2-OG 3.5Å; R324-E389 IonicContact CZ-OE1 2.61Å; R324-E389 IonicContact NE-OE1 3.64Å; R324-E389 IonicContact NH2-OE1 2.7Å; R324-E389 PolarHBondContact NH2-OE1 3.48Å
325	R	98.7	Very high	98	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.8	-172.7	-48.7	-65.7	-172.4	-176.5	3.1	111.4	F305 I306 D336 E337 R339 T365 E389	F305-R325 WeakPolarHBondContact CA-O 3.49Å; I306-R325 HydrophobicContact CB-CB 3.98Å; I306-R325 HydrophobicContact CB-CG 4.12Å; I306-R325 HydrophobicContact CD1-CB 4.39Å; I306-R325 HydrophobicContact CD1-CG 4.14Å; I306-R325 HydrophobicContact CG1-CB 4.3Å; I306-R325 HydrophobicContact CG1-CG 4.48Å; I306-R325 PolarHBondContact N-O 3.48Å; I306-R325 PolarHBondContact O-N 3.38Å; R325-D336 WeakPolarHBondContact CB-OD1 3.3Å; R325-D336 WeakPolarHBondContact CD-O 3.4Å; R325-D336 WeakPolarHBondContact CG-OD1 3.43Å; R325-D336 VanDerWaalsContact CZ-O 3.31Å; R325-D336 PolarHBondContact NE-O 3Å; R325-D336 IonicContact NE-OD2 3.42Å; R325-E337 PolarHBondContact NH1-O 2.98Å; R325-R339 CarbonylContact C-O 3.6Å; R325-R339 WeakPolarHBondContact CA-O 3.36Å; R325-R339 HydrophobicContact CB-CB 4.1Å; R325-T365 PolarHBondContact NH1-O 2.86Å; R325-E389 IonicContact NH2-OE1 3.2Å
326	A	98.6	Very high	98	Very high	21 Å²	21	47 Å²	47	17%	0.174	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	124.5	171.1	0	0	0	0	0	110.5	I299 F305 R339 T341 L343	I299-A326 HydrophobicContact CD1-CB 4.3Å; F305-A326 HydrophobicContact CD1-CB 3.65Å; F305-A326 HydrophobicContact CE1-CB 3.55Å; A326-R339 PolarHBondContact N-O 3.12Å; A326-T341 HydrophobicContact CB-CG2 3.94Å; A326-L343 HydrophobicContact CB-CD1 4.06Å
327	S	98.4	Very high	97.9	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.028	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	145.5	-178.5	-171.7	0	0	0	0	112.2	I299 G303 Y304 E329	I299-S327 VanDerWaalsContact CG2-O 3.29Å; I299-S327 WeakPolarHBondContact CG2-O 3.44Å; G303-S327 CarbonylContact C-O 3.52Å; G303-S327 WeakPolarHBondContact CA-O 3.03Å; Y304-S327 VanDerWaalsContact CE1-CB 3.46Å; Y304-S327 PolarHBondContact N-O 3.07Å; Y304-S327 PolarHBondContact O-N 3.38Å; S327-E329 PolarHBondContact OG-N 2.95Å; S327-E329 PolarHBondContact OG-O 2.84Å
328	K	98.1	Very high	97.8	Very high	150 Å²	150	48.8 Å²	48.8	65%	0.652	23%	0.227	S	C	*	.	S	Bend	trans	-93.7	-6.6	167.4	-64.1	-168.1	175.1	-161.4	0	112.8	G298	G298-K328 WeakPolarHBondContact O-CE 3.47Å; G298-K328 PolarHBondContact O-NZ 2.82Å
329	E	98	Very high	97.8	Very high	111 Å²	111	49.8 Å²	49.8	52%	0.519	23%	0.23	S	C	.	.	S	Bend	trans	-98.1	164.4	177.1	-67.5	159.6	-119.5	0	0	110.1	Y304 S327 R339	Y304-E329 WeakPolarHBondContact CD1-O 3.29Å; Y304-E329 VanDerWaalsContact CE1-O 3.28Å; Y304-E329 WeakPolarHBondContact CE1-O 3.33Å; S327-E329 PolarHBondContact OG-N 2.95Å; S327-E329 PolarHBondContact OG-O 2.84Å; E329-R339 IonicContact OE1-CZ 3.56Å; E329-R339 IonicContact OE1-NH1 2.69Å; E329-R339 PolarHBondContact OE1-NH1 3.28Å; E329-R339 IonicContact OE1-NH2 3.66Å; E329-R339 IonicContact OE2-CZ 3.13Å; E329-R339 IonicContact OE2-NH1 2.71Å; E329-R339 PolarHBondContact OE2-NH1 3.41Å; E329-R339 IonicContact OE2-NH2 2.89Å; E329-R339 PolarHBondContact OE2-NH2 3.39Å
330	R	97.8	Very high	97.7	Very high	139 Å²	139	49.6 Å²	49.6	53%	0.525	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-59.2	146.8	172.6	-174.5	-174.5	-68.9	-98.8	3.7	110.4	Q261 G262 P302 E332	Q261-R330 WeakPolarHBondContact O-CD 3.45Å; G262-R330 PolarHBondContact O-NH1 2.82Å; P302-R330 HydrophobicContact CB-CB 3.91Å; P302-R330 HydrophobicContact CB-CG 4.29Å; P302-R330 HydrophobicContact CG-CB 4.02Å; R330-E332 PolarHBondContact O-N 3.15Å
331	Y	98.2	Very high	97.7	Very high	41 Å²	41	49.6 Å²	49.6	16%	0.161	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-58.4	132.6	169.2	177.9	-94.4	0	0	0	111.4	T258 Q261 G262 Y304 I306 D336	T258-Y331 VanDerWaalsContact OG1-CD1 3.27Å; T258-Y331 WeakPolarHBondContact OG1-CD1 3.48Å; Q261-Y331 CarbonylContact C-O 3.42Å; G262-Y331 WeakPolarHBondContact CA-O 3.48Å; G262-Y331 PolarHBondContact N-O 3.42Å; Y304-Y331 HydrophobicContact CE1-CD2 4.4Å; Y304-Y331 VanDerWaalsContact CE1-N 3.29Å; Y304-Y331 AromaticContact CE2-CD2 3.93Å; Y304-Y331 HydrophobicContact CE2-CD2 3.93Å; Y304-Y331 AromaticContact CZ-CD2 3.81Å; I306-Y331 HydrophobicContact CD1-CE2 4.24Å; Y331-D336 HydrophobicContact CD2-CB 4.29Å; Y331-D336 HydrophobicContact CE2-CB 3.86Å
332	E	97.2	Very high	97.7	Very high	67 Å²	67	50.1 Å²	50.1	31%	0.313	23%	0.234	S	C	.	.			trans	-145.7	134.8	164	-174.6	-80.1	130.9	0	0	106.2	T260 R330 T334 A335 D336	T260-E332 WeakPolarHBondContact O-CA 3.23Å; R330-E332 PolarHBondContact O-N 3.15Å; E332-T334 VanDerWaalsContact CD-N 3.35Å; E332-T334 PolarHBondContact O-N 2.82Å; E332-T334 VanDerWaalsContact OE1-CB 3.3Å; E332-T334 WeakPolarHBondContact OE1-CB 3.44Å; E332-T334 PolarHBondContact OE1-N 3.39Å; E332-T334 PolarHBondContact OE1-OG1 2.81Å; E332-T334 WeakPolarHBondContact OE2-CB 3.46Å; E332-T334 PolarHBondContact OE2-N 3.35Å; E332-A335 HydrophobicContact CB-CB 4.28Å; E332-A335 PolarHBondContact O-N 2.87Å; E332-A335 VanDerWaalsContact OE2-CB 3.27Å; E332-A335 WeakPolarHBondContact OE2-CB 3.4Å; E332-A335 PolarHBondContact OE2-N 2.96Å; E332-D336 WeakPolarHBondContact O-CB 3.38Å; E332-D336 PolarHBondContact O-N 3.4Å
333	E	94.3	Very high	97.6	Very high	105 Å²	105	50.6 Å²	50.6	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-57.7	-47.9	-167	-174.4	169.7	-117.4	0	0	112.6	T260 D336	T260-E333 HydrophobicContact CG2-CB 4.32Å; T260-E333 VanDerWaalsContact CG2-CD 3.44Å; T260-E333 HydrophobicContact CG2-CG 4.49Å; T260-E333 WeakPolarHBondContact CG2-OE1 3.42Å; T260-E333 WeakPolarHBondContact CG2-OE2 3.19Å; T260-E333 PolarHBondContact O-N 2.88Å; T260-E333 VanDerWaalsContact O-N 3.11Å; E333-D336 PolarHBondContact O-N 3.25Å
334	T	94.8	Very high	97.6	Very high	96 Å²	96	51 Å²	51	59%	0.589	24%	0.239	S	C	*	.	H	α-helix	trans	-66.8	-40.5	179.7	-33	0	0	0	0	112	E332 D336	E332-T334 VanDerWaalsContact CD-N 3.35Å; E332-T334 PolarHBondContact O-N 2.82Å; E332-T334 VanDerWaalsContact OE1-CB 3.3Å; E332-T334 WeakPolarHBondContact OE1-CB 3.44Å; E332-T334 PolarHBondContact OE1-N 3.39Å; E332-T334 PolarHBondContact OE1-OG1 2.81Å; E332-T334 WeakPolarHBondContact OE2-CB 3.46Å; E332-T334 PolarHBondContact OE2-N 3.35Å; T334-D336 VanDerWaalsContact C-N 3.3Å; T334-D336 PolarHBondContact O-N 2.86Å
335	A	96.3	Very high	97.6	Very high	30 Å²	30	50.8 Å²	50.8	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-72.8	-22	-179.8	0	0	0	0	0	113.1	E332 R338 R339	E332-A335 HydrophobicContact CB-CB 4.28Å; E332-A335 PolarHBondContact O-N 2.87Å; E332-A335 VanDerWaalsContact OE2-CB 3.27Å; E332-A335 WeakPolarHBondContact OE2-CB 3.4Å; E332-A335 PolarHBondContact OE2-N 2.96Å; A335-R338 PolarHBondContact O-N 2.95Å; A335-R339 VanDerWaalsContact O-CG 3.31Å; A335-R339 WeakPolarHBondContact O-CG 3.31Å; A335-R339 PolarHBondContact O-NE 3.06Å
336	D	97.4	Very high	97.6	Very high	14 Å²	14	51.3 Å²	51.3	8%	0.075	24%	0.242	C	C	.	.	H	α-helix	trans	-71.7	-30.5	-179.2	-168.5	53.7	0	0	0	113.1	Y304 I306 R325 Y331 E332 E333 T334 R338 R339	Y304-D336 WeakPolarHBondContact CE2-OD1 3.26Å; Y304-D336 PolarHBondContact OH-OD1 2.85Å; I306-D336 VanDerWaalsContact CD1-OD2 3.31Å; I306-D336 WeakPolarHBondContact CD1-OD2 3.42Å; R325-D336 WeakPolarHBondContact CB-OD1 3.3Å; R325-D336 WeakPolarHBondContact CD-O 3.4Å; R325-D336 WeakPolarHBondContact CG-OD1 3.43Å; R325-D336 VanDerWaalsContact CZ-O 3.31Å; R325-D336 PolarHBondContact NE-O 3Å; R325-D336 IonicContact NE-OD2 3.42Å; Y331-D336 HydrophobicContact CD2-CB 4.29Å; Y331-D336 HydrophobicContact CE2-CB 3.86Å; E332-D336 WeakPolarHBondContact O-CB 3.38Å; E332-D336 PolarHBondContact O-N 3.4Å; E333-D336 PolarHBondContact O-N 3.25Å; T334-D336 VanDerWaalsContact C-N 3.3Å; T334-D336 PolarHBondContact O-N 2.86Å; D336-R338 PolarHBondContact O-N 3.43Å; D336-R339 PolarHBondContact O-N 2.91Å
337	E	96.4	Very high	97.7	Very high	58 Å²	58	50.3 Å²	50.3	27%	0.271	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-31.9	170.5	-70	-173.1	-172.2	0	0	112.3	R325 E389 A391	R325-E337 PolarHBondContact NH1-O 2.98Å; E337-E389 WeakPolarHBondContact CB-O 3.21Å; E337-A391 PolarHBondContact OE2-N 2.8Å
338	R	97.5	Very high	97.7	Very high	135 Å²	135	50.7 Å²	50.7	51%	0.509	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	19.9	-177.8	-61.3	179.5	-179	-86.1	-3.3	114.2	A335 D336 P364 T365 D390	A335-R338 PolarHBondContact O-N 2.95Å; D336-R338 PolarHBondContact O-N 3.43Å; R338-P364 CarbonylContact C-O 3.57Å; R338-P364 VanDerWaalsContact CA-O 3.26Å; R338-P364 WeakPolarHBondContact CA-O 3.47Å; R338-P364 HydrophobicContact CB-CB 4.4Å; R338-P364 WeakPolarHBondContact O-CB 3.42Å; R338-T365 HydrophobicContact CG-CG2 4.23Å; R338-D390 IonicContact CZ-OD1 3.27Å; R338-D390 IonicContact CZ-OD2 3.89Å; R338-D390 VanDerWaalsContact CZ-OD2 3.29Å; R338-D390 IonicContact NE-OD1 3.78Å; R338-D390 IonicContact NH1-OD2 2.72Å; R338-D390 PolarHBondContact NH1-OD2 2.96Å; R338-D390 IonicContact NH2-OD1 3.19Å; R338-D390 PolarHBondContact NH2-OD1 2.95Å; R338-D390 IonicContact NH2-OD2 2.67Å; R338-D390 PolarHBondContact NH2-OD2 3.33Å
339	R	98.1	Very high	97.7	Very high	53 Å²	53	46.6 Å²	46.6	20%	0.2	23%	0.225	C	C	.	.			trans	-104.8	16.4	176.2	-53.9	-58.6	173.5	153.9	7.7	114	R325 A326 E329 A335 D336 P364	R325-R339 CarbonylContact C-O 3.6Å; R325-R339 WeakPolarHBondContact CA-O 3.36Å; R325-R339 HydrophobicContact CB-CB 4.1Å; A326-R339 PolarHBondContact N-O 3.12Å; E329-R339 IonicContact OE1-CZ 3.56Å; E329-R339 IonicContact OE1-NH1 2.69Å; E329-R339 PolarHBondContact OE1-NH1 3.28Å; E329-R339 IonicContact OE1-NH2 3.66Å; E329-R339 IonicContact OE2-CZ 3.13Å; E329-R339 IonicContact OE2-NH1 2.71Å; E329-R339 PolarHBondContact OE2-NH1 3.41Å; E329-R339 IonicContact OE2-NH2 2.89Å; E329-R339 PolarHBondContact OE2-NH2 3.39Å; A335-R339 VanDerWaalsContact O-CG 3.31Å; A335-R339 WeakPolarHBondContact O-CG 3.31Å; A335-R339 PolarHBondContact O-NE 3.06Å; D336-R339 PolarHBondContact O-N 2.91Å; R339-P364 PolarHBondContact N-O 3.39Å
340	G	98.4	Very high	97.7	Very high	2 Å²	2	45.2 Å²	45.2	2%	0.021	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-47.9	146.3	170.1	0	0	0	0	0	111.8	R324 H362 P364	R324-G340 WeakPolarHBondContact O-CA 3.31Å; G340-H362 PolarHBondContact O-CD2 3.39Å; G340-H362 PolarHBondContact O-NE2 3.34Å; G340-P364 VanDerWaalsContact CA-O 3.28Å; G340-P364 WeakPolarHBondContact CA-O 3.3Å; G340-P364 PolarHBondContact N-O 3.3Å
341	T	98.5	Very high	97.7	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.043	20%	0.198	C	C	.	.			trans	-137.1	166	-172.1	-169.6	0	0	0	0	112.6	P323 R324 A326 L343	P323-T341 HydrophobicContact CB-CG2 4.13Å; P323-T341 WeakPolarHBondContact O-CG2 3.39Å; R324-T341 PolarHBondContact O-N 2.92Å; A326-T341 HydrophobicContact CB-CG2 3.94Å; T341-L343 WeakPolarHBondContact OG1-CG 3.41Å; T341-L343 PolarHBondContact OG1-N 3.35Å
342	N	97.9	Very high	97.7	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.059	23%	0.226	C	C	.	.			trans	-122.4	21.2	177.2	80.2	-27.6	0	0	0	112.6	R358 V359 G360	N342-R358 CarbonylContact O-C 3.53Å; N342-R358 VanDerWaalsContact O-CA 3.23Å; N342-R358 WeakPolarHBondContact O-CA 3.13Å; N342-R358 PolarHBondContact OD1-NH1 2.78Å; N342-V359 WeakPolarHBondContact CB-O 3.17Å; N342-V359 PolarHBondContact O-N 2.98Å; N342-G360 PolarHBondContact ND2-O 2.7Å
343	L	98.4	Very high	97.8	Very high	11 Å²	11	45.1 Å²	45.1	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	141.2	-178.7	-73	171.3	0	0	0	111.8	F305 A326 T341 V356 S357 R358	F305-L343 HydrophobicContact CE1-CD1 3.75Å; F305-L343 HydrophobicContact CZ-CD1 4.11Å; A326-L343 HydrophobicContact CB-CD1 4.06Å; T341-L343 WeakPolarHBondContact OG1-CG 3.41Å; T341-L343 PolarHBondContact OG1-N 3.35Å; L343-V356 HydrophobicContact CD2-CG1 3.67Å; L343-S357 WeakPolarHBondContact CA-O 3.27Å; L343-R358 HydrophobicContact CD2-CG 3.86Å
344	V	98.6	Very high	98	Very high	8 Å²	8	41.5 Å²	41.5	5%	0.048	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.6	165.9	-170.4	0	0	0	0	107.7	F320 L322 V356 S357 V359	F320-V344 HydrophobicContact CD1-CG1 4.46Å; L322-V344 HydrophobicContact CD2-CB 3.91Å; L322-V344 HydrophobicContact CD2-CG1 3.73Å; L322-V344 HydrophobicContact CD2-CG2 3.58Å; V344-V356 WeakPolarHBondContact O-CA 3.18Å; V344-S357 PolarHBondContact N-O 3.34Å; V344-S357 PolarHBondContact O-N 3.09Å; V344-V359 HydrophobicContact CG2-CB 4.15Å; V344-V359 HydrophobicContact CG2-CG1 3.63Å
345	L	98.9	Very high	98.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	130.1	173.3	-51.8	176.9	0	0	0	108.2	M293 F305 F320 F321 P323 V356	M293-L345 HydrophobicContact CB-CD1 4.06Å; M293-L345 HydrophobicContact CG-CD1 4.22Å; M293-L345 HydrophobicContact SD-CD1 3.89Å; F305-L345 HydrophobicContact CE2-CD1 4.01Å; F305-L345 HydrophobicContact CZ-CD1 4.12Å; F305-L345 HydrophobicContact CZ-CD2 4.27Å; F320-L345 CarbonylContact C-O 3.58Å; F320-L345 VanDerWaalsContact CA-O 3.25Å; F320-L345 WeakPolarHBondContact CA-O 3.46Å; F321-L345 HydrophobicContact CB-CB 4.24Å; F321-L345 HydrophobicContact CB-CD1 4.37Å; F321-L345 PolarHBondContact N-O 2.93Å; F321-L345 PolarHBondContact O-N 3.42Å; P323-L345 HydrophobicContact CG-CD1 3.92Å; P323-L345 HydrophobicContact CG-CG 4.32Å; L345-V356 HydrophobicContact CD2-CB 4.28Å; L345-V356 HydrophobicContact CD2-CG1 3.95Å; L345-V356 HydrophobicContact CD2-CG2 3.71Å
346	S	98.8	Very high	98.3	Very high	15 Å²	15	44 Å²	44	11%	0.105	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.5	173.5	-175.7	0	0	0	0	109.3	R318 W319 F320 I354 K355	R318-S346 WeakPolarHBondContact CD-OG 3.33Å; R318-S346 PolarHBondContact NE-OG 2.63Å; R318-S346 PolarHBondContact NH2-O 3.23Å; W319-S346 CarbonylContact O-C 3.56Å; W319-S346 WeakPolarHBondContact O-CA 3.31Å; F320-S346 VanDerWaalsContact CE1-CB 3.5Å; F320-S346 WeakPolarHBondContact CE1-OG 3.37Å; F320-S346 WeakPolarHBondContact CZ-OG 3.18Å; S346-I354 WeakPolarHBondContact O-CA 3.01Å; S346-K355 PolarHBondContact N-O 2.92Å; S346-K355 PolarHBondContact O-N 2.88Å
347	C	98.9	Very high	98.3	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.3	-168.3	-53.7	0	0	0	0	110.9	R318 W319 F351 D353 I354	R318-C347 CarbonylContact C-O 3.57Å; R318-C347 VanDerWaalsContact CA-O 3.28Å; R318-C347 WeakPolarHBondContact CA-O 3.36Å; R318-C347 VanDerWaalsContact CB-O 3.31Å; R318-C347 WeakPolarHBondContact CB-O 3.4Å; W319-C347 HydrophobicContact CB-CB 4.2Å; W319-C347 PolarHBondContact N-O 2.79Å; W319-C347 PolarHBondContact O-N 2.94Å; C347-F351 HydrophobicContact CB-CD1 3.79Å; C347-F351 HydrophobicContact CB-CE1 3.92Å; C347-F351 HydrophobicContact CB-CG 4.31Å; C347-D353 CarbonylContact C-O 3.52Å; C347-D353 WeakPolarHBondContact CA-O 3.49Å; C347-I354 HydrophobicContact CB-CG1 4.09Å
348	S	98.8	Very high	98.4	Very high	12 Å²	12	50.2 Å²	50.2	8%	0.084	24%	0.241	C	C	.	.			trans	-59.4	161.4	165.4	61.8	0	0	0	0	111.3	D350 F351 K352 D353	S348-D350 WeakPolarHBondContact CB-OD1 3.34Å; S348-D350 PolarHBondContact O-N 2.71Å; S348-D350 VanDerWaalsContact O-N 3.1Å; S348-D350 PolarHBondContact OG-OD1 2.86Å; S348-F351 PolarHBondContact O-N 3.25Å; S348-F351 PolarHBondContact OG-N 3.34Å; S348-K352 PolarHBondContact OG-N 3.13Å; S348-K352 VanDerWaalsContact OG-N 3.11Å; S348-D353 PolarHBondContact N-O 2.81Å; S348-D353 PolarHBondContact OG-N 2.89Å
349	P	98.6	Very high	98.3	Very high	64 Å²	64	44.1 Å²	44.1	42%	0.416	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.7	-176.8	-22.7	34	0	0	0	113.4	W312 Q317	W312-P349 HydrophobicContact CH2-CB 4.23Å; W312-P349 HydrophobicContact CH2-CG 3.77Å; W312-P349 HydrophobicContact CZ3-CB 4.14Å; W312-P349 HydrophobicContact CZ3-CG 3.91Å; Q317-P349 WeakPolarHBondContact O-CD 3.35Å; Q317-P349 WeakPolarHBondContact O-CG 3.27Å
350	D	98.1	Very high	98.1	Very high	82 Å²	82	43.3 Å²	43.3	44%	0.439	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	5.1	177.8	70.5	-14.6	0	0	0	114.1	S348 K352	S348-D350 WeakPolarHBondContact CB-OD1 3.34Å; S348-D350 PolarHBondContact O-N 2.71Å; S348-D350 VanDerWaalsContact O-N 3.1Å; S348-D350 PolarHBondContact OG-OD1 2.86Å; D350-K352 HydrophobicContact CB-CG 4.45Å; D350-K352 PolarHBondContact O-N 3.41Å; D350-K352 VanDerWaalsContact O-N 3.14Å; D350-K352 PolarHBondContact OD1-N 3.11Å; D350-K352 VanDerWaalsContact OD2-CD 3.32Å; D350-K352 WeakPolarHBondContact OD2-CD 3.05Å; D350-K352 WeakPolarHBondContact OD2-CG 3.36Å; D350-K352 IonicContact OD2-NZ 2.69Å; D350-K352 PolarHBondContact OD2-NZ 2.98Å
351	F	98.6	Very high	97.8	Very high	6 Å²	6	48 Å²	48	3%	0.026	26%	0.257	C	S	.	.	S	Bend	trans	56.4	23.1	-180	-68	-108.8	0	0	0	114.8	W286 R289 M293 W319 F321 C347 S348 I354	W286-F351 HydrophobicContact CE3-CZ 4.46Å; W286-F351 HydrophobicContact CH2-CZ 4.25Å; W286-F351 AromaticContact CZ3-CZ 3.93Å; W286-F351 HydrophobicContact CZ3-CZ 3.93Å; R289-F351 HydrophobicContact CB-CB 4.47Å; R289-F351 HydrophobicContact CB-CD1 3.83Å; R289-F351 HydrophobicContact CB-CD2 4.24Å; R289-F351 HydrophobicContact CB-CE1 4.05Å; R289-F351 HydrophobicContact CB-CE2 4.46Å; R289-F351 HydrophobicContact CB-CG 3.93Å; R289-F351 HydrophobicContact CB-CZ 4.37Å; R289-F351 HydrophobicContact CG-CB 4.26Å; R289-F351 HydrophobicContact CG-CD1 4.27Å; R289-F351 HydrophobicContact CG-CD2 3.78Å; R289-F351 HydrophobicContact CG-CE2 4.15Å; R289-F351 HydrophobicContact CG-CG 3.85Å; M293-F351 HydrophobicContact CE-CE1 4.25Å; M293-F351 HydrophobicContact CG-CD1 4.29Å; M293-F351 HydrophobicContact CG-CE1 4.45Å; M293-F351 HydrophobicContact SD-CD1 4.46Å; M293-F351 HydrophobicContact SD-CE1 4.04Å; W319-F351 HydrophobicContact CB-CZ 4.12Å; W319-F351 AromaticContact CD1-CE2 3.64Å; W319-F351 AromaticContact CD1-CZ 3.84Å; W319-F351 HydrophobicContact CG-CE2 4.2Å; W319-F351 AromaticContact CG-CZ 3.92Å; W319-F351 HydrophobicContact CG-CZ 3.92Å; F321-F351 AromaticContact CE2-CE1 3.73Å; F321-F351 HydrophobicContact CE2-CE1 3.73Å; F321-F351 HydrophobicContact CE2-CZ 4.01Å; F321-F351 HydrophobicContact CZ-CE1 4.02Å; F321-F351 HydrophobicContact CZ-CZ 4.02Å; C347-F351 HydrophobicContact CB-CD1 3.79Å; C347-F351 HydrophobicContact CB-CE1 3.92Å; C347-F351 HydrophobicContact CB-CG 4.31Å; S348-F351 PolarHBondContact O-N 3.25Å; S348-F351 PolarHBondContact OG-N 3.34Å; F351-I354 HydrophobicContact CB-CD1 4.38Å; F351-I354 HydrophobicContact CD1-CD1 4.44Å; F351-I354 WeakPolarHBondContact O-CD1 3.5Å
352	K	98.1	Very high	97.8	Very high	171 Å²	171	52.8 Å²	52.8	74%	0.743	28%	0.279	S	S	*	.	S	Bend	trans	-87.3	-29.1	175.6	-64.1	-165.7	-166.3	84.7	0	114.2	S348 D350	S348-K352 PolarHBondContact OG-N 3.13Å; S348-K352 VanDerWaalsContact OG-N 3.11Å; D350-K352 HydrophobicContact CB-CG 4.45Å; D350-K352 PolarHBondContact O-N 3.41Å; D350-K352 VanDerWaalsContact O-N 3.14Å; D350-K352 PolarHBondContact OD1-N 3.11Å; D350-K352 VanDerWaalsContact OD2-CD 3.32Å; D350-K352 WeakPolarHBondContact OD2-CD 3.05Å; D350-K352 WeakPolarHBondContact OD2-CG 3.36Å; D350-K352 IonicContact OD2-NZ 2.69Å; D350-K352 PolarHBondContact OD2-NZ 2.98Å
353	D	98.6	Very high	97.7	Very high	68 Å²	68	54.6 Å²	54.6	36%	0.364	29%	0.288	S	S	.	.	S	Bend	trans	-112	105.7	172.3	167	57.8	0	0	0	108.9	R318 C347 S348	R318-D353 IonicContact CZ-OD2 3.37Å; R318-D353 IonicContact NH1-OD2 3.41Å; R318-D353 PolarHBondContact NH1-OD2 3.4Å; R318-D353 PolarHBondContact NH2-O 3.35Å; R318-D353 IonicContact NH2-OD2 3.81Å; R318-D353 PolarHBondContact NH2-OD2 2.9Å; C347-D353 CarbonylContact C-O 3.52Å; C347-D353 WeakPolarHBondContact CA-O 3.49Å; S348-D353 PolarHBondContact N-O 2.81Å; S348-D353 PolarHBondContact OG-N 2.89Å
354	I	98.9	Very high	97.7	Very high	29 Å²	29	56.7 Å²	56.7	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121.4	-179.4	-58.6	177	0	0	0	108.6	M293 A296 S346 C347 F351 V356	M293-I354 HydrophobicContact CG-CD1 3.94Å; A296-I354 HydrophobicContact CB-CB 3.67Å; A296-I354 HydrophobicContact CB-CD1 4.38Å; A296-I354 HydrophobicContact CB-CG2 3.49Å; A296-I354 VanDerWaalsContact CB-CG2 3.49Å; S346-I354 WeakPolarHBondContact O-CA 3.01Å; C347-I354 HydrophobicContact CB-CG1 4.09Å; F351-I354 HydrophobicContact CB-CD1 4.38Å; F351-I354 HydrophobicContact CD1-CD1 4.44Å; F351-I354 WeakPolarHBondContact O-CD1 3.5Å; I354-V356 HydrophobicContact CG2-CG2 4.44Å
355	K	98.6	Very high	97.7	Very high	122 Å²	122	56.9 Å²	56.9	53%	0.53	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.5	177.8	-63.3	175.1	-174.3	174.8	0	108.5	S346	S346-K355 PolarHBondContact N-O 2.92Å; S346-K355 PolarHBondContact O-N 2.88Å
356	V	98.4	Very high	97.7	Very high	55 Å²	55	57.6 Å²	57.6	33%	0.333	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	118.3	-178.9	-175.5	0	0	0	0	108.4	A296 A297 L343 V344 L345 I354	A296-V356 HydrophobicContact CB-CG2 4.14Å; A296-V356 WeakPolarHBondContact O-CG2 3.25Å; A297-V356 HydrophobicContact CB-CG1 4.47Å; A297-V356 HydrophobicContact CB-CG2 4.39Å; L343-V356 HydrophobicContact CD2-CG1 3.67Å; V344-V356 WeakPolarHBondContact O-CA 3.18Å; L345-V356 HydrophobicContact CD2-CB 4.28Å; L345-V356 HydrophobicContact CD2-CG1 3.95Å; L345-V356 HydrophobicContact CD2-CG2 3.71Å; I354-V356 HydrophobicContact CG2-CG2 4.44Å
357	S	97.7	Very high	97.7	Very high	52 Å²	52	56.9 Å²	56.9	36%	0.364	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	-178.4	174.3	69.1	0	0	0	0	110.8	L343 V344	L343-S357 WeakPolarHBondContact CA-O 3.27Å; V344-S357 PolarHBondContact N-O 3.34Å; V344-S357 PolarHBondContact O-N 3.09Å
358	R	97	Very high	97.7	Very high	151 Å²	151	57 Å²	57	57%	0.57	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.1	177.9	-72.9	-179.8	-172.7	-82.4	-1.8	110.3	N342 L343	N342-R358 CarbonylContact O-C 3.53Å; N342-R358 VanDerWaalsContact O-CA 3.23Å; N342-R358 WeakPolarHBondContact O-CA 3.13Å; N342-R358 PolarHBondContact OD1-NH1 2.78Å; L343-R358 HydrophobicContact CD2-CG 3.86Å
359	V	96.3	Very high	97.7	Very high	8 Å²	8	56.4 Å²	56.4	5%	0.048	30%	0.299	C	S	.	.			trans	-132.8	130.5	179.8	58.1	0	0	0	0	112.2	N342 V344 F368 F401	N342-V359 WeakPolarHBondContact CB-O 3.17Å; N342-V359 PolarHBondContact O-N 2.98Å; V344-V359 HydrophobicContact CG2-CB 4.15Å; V344-V359 HydrophobicContact CG2-CG1 3.63Å; V359-F368 HydrophobicContact CG1-CE2 4.35Å; V359-F368 HydrophobicContact CG1-CZ 3.93Å; V359-F401 HydrophobicContact CB-CD2 4.33Å; V359-F401 HydrophobicContact CB-CE2 4.35Å; V359-F401 HydrophobicContact CG1-CD2 4.48Å; V359-F401 HydrophobicContact CG1-CE1 4.19Å; V359-F401 HydrophobicContact CG1-CE2 4.05Å; V359-F401 HydrophobicContact CG1-CZ 3.89Å; V359-F401 HydrophobicContact CG2-CB 3.67Å; V359-F401 HydrophobicContact CG2-CD1 3.67Å; V359-F401 HydrophobicContact CG2-CD2 3.57Å; V359-F401 HydrophobicContact CG2-CE1 4.1Å; V359-F401 HydrophobicContact CG2-CE2 3.99Å; V359-F401 HydrophobicContact CG2-CG 3.37Å; V359-F401 HydrophobicContact CG2-CZ 4.24Å
360	G	93.1	Very high	97.7	Very high	35 Å²	35	53.4 Å²	53.4	36%	0.361	28%	0.279	S	S	.	.	S	Bend	trans	60.2	-172.2	178.7	0	0	0	0	0	114.7	N342	N342-G360 PolarHBondContact ND2-O 2.7Å
361	P	93.8	Very high	97.7	Very high	102 Å²	102	49.5 Å²	49.5	66%	0.662	26%	0.258	S	S	*	.			trans	-68.8	150.1	175.3	29.9	-34.4	0	0	0	111.6
362	H	96.7	Very high	97.7	Very high	106 Å²	106	49.9 Å²	49.9	49%	0.491	26%	0.26	S	S	.	.			trans	-82.3	126.3	169.8	174.8	-134.5	0	0	0	109.8	G340	G340-H362 PolarHBondContact O-CD2 3.39Å; G340-H362 PolarHBondContact O-NE2 3.34Å
363	N	97.7	Very high	97.8	Very high	50 Å²	50	42.4 Å²	42.4	27%	0.267	23%	0.227	S	C	.	.			trans	-119	123.1	167.9	-175.1	-8.7	0	0	0	108.5	T365 H366	N363-T365 VanDerWaalsContact C-N 3.35Å; N363-T365 PolarHBondContact O-N 2.99Å; N363-T365 PolarHBondContact OD1-N 2.93Å; N363-T365 PolarHBondContact OD1-OG1 3.33Å; N363-H366 HydrophobicContact CB-CB 4.23Å; N363-H366 PolarHBondContact ND2-CD2 3.08Å; N363-H366 PolarHBondContact ND2-CE1 2.81Å; N363-H366 PolarHBondContact ND2-ND1 2.67Å; N363-H366 PolarHBondContact ND2-NE2 2.67Å
364	P	97.9	Very high	97.8	Very high	55 Å²	55	39.2 Å²	39.2	36%	0.357	21%	0.21	S	C	.	.	S	Bend	trans	-62.8	-30.7	180	-25.7	35.7	0	0	0	115.6	R338 R339 G340	R338-P364 CarbonylContact C-O 3.57Å; R338-P364 VanDerWaalsContact CA-O 3.26Å; R338-P364 WeakPolarHBondContact CA-O 3.47Å; R338-P364 HydrophobicContact CB-CB 4.4Å; R338-P364 WeakPolarHBondContact O-CB 3.42Å; R339-P364 PolarHBondContact N-O 3.39Å; G340-P364 VanDerWaalsContact CA-O 3.28Å; G340-P364 WeakPolarHBondContact CA-O 3.3Å; G340-P364 PolarHBondContact N-O 3.3Å
365	T	98	Very high	97.8	Very high	11 Å²	11	38.4 Å²	38.4	7%	0.067	21%	0.207	C	C	.	.	S	Bend	trans	-90.6	-22.5	-174.3	55.3	0	0	0	0	113.5	R325 R338 N363 E388 D390	R325-T365 PolarHBondContact NH1-O 2.86Å; R338-T365 HydrophobicContact CG-CG2 4.23Å; N363-T365 VanDerWaalsContact C-N 3.35Å; N363-T365 PolarHBondContact O-N 2.99Å; N363-T365 PolarHBondContact OD1-N 2.93Å; N363-T365 PolarHBondContact OD1-OG1 3.33Å; T365-E388 VanDerWaalsContact CB-OE1 3.29Å; T365-E388 WeakPolarHBondContact CB-OE1 3.41Å; T365-E388 PolarHBondContact OG1-OE1 2.92Å; T365-D390 HydrophobicContact CG2-CB 3.82Å
366	H	98.4	Very high	97.6	Very high	16 Å²	16	38.7 Å²	38.7	7%	0.074	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	114.9	-178.5	-58.5	-166.8	0	0	0	110.6	N363 K386 E388 Y397 E411	N363-H366 HydrophobicContact CB-CB 4.23Å; N363-H366 PolarHBondContact ND2-CD2 3.08Å; N363-H366 PolarHBondContact ND2-CE1 2.81Å; N363-H366 PolarHBondContact ND2-ND1 2.67Å; N363-H366 PolarHBondContact ND2-NE2 2.67Å; H366-K386 HydrophobicContact CB-CB 4.21Å; H366-K386 HydrophobicContact CB-CD 3.83Å; H366-E388 IonicContact CD2-OE1 2.74Å; H366-E388 PolarHBondContact CD2-OE1 2.77Å; H366-E388 IonicContact NE2-OE1 3.68Å; H366-E388 PolarHBondContact NE2-OE1 2.98Å; H366-E388 IonicContact NE2-OE2 3.24Å; H366-Y397 AromaticContact CE1-CD2 3.51Å; H366-Y397 AromaticContact CE1-CE2 3.21Å; H366-Y397 WeakPolarHBondContact CE1-CE2 3.43Å; H366-Y397 AromaticContact CE1-CZ 3.56Å; H366-Y397 AromaticContact ND1-CD2 3.53Å; H366-Y397 AromaticContact ND1-CE2 3.7Å; H366-Y397 AromaticContact NE2-CE2 3.54Å; H366-Y397 AromaticContact NE2-CZ 3.95Å; H366-E411 IonicContact CE1-OE1 3.46Å; H366-E411 IonicContact CG-OE1 3.07Å; H366-E411 IonicContact ND1-OE1 3.68Å; H366-E411 PolarHBondContact ND1-OE1 3.44Å
367	G	98.6	Very high	97.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	143.2	175.1	0	0	0	0	0	111.8	R324 S369 K386 S387	R324-G367 VanDerWaalsContact O-CA 3.26Å; R324-G367 WeakPolarHBondContact O-CA 3.13Å; G367-S369 PolarHBondContact O-N 2.88Å; G367-K386 CarbonylContact O-C 3.56Å; G367-K386 WeakPolarHBondContact O-CA 3.31Å; G367-K386 VanDerWaalsContact O-CB 3.3Å; G367-K386 WeakPolarHBondContact O-CB 3.16Å; G367-S387 PolarHBondContact N-O 3.17Å; G367-S387 PolarHBondContact O-N 2.71Å
368	F	98.9	Very high	97.6	Very high	2 Å²	2	40.2 Å²	40.2	1%	0.009	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	129.7	174.6	-72.8	-71.2	0	0	0	111.5	L322 R324 V359 A384 L385 K386 F401	L322-F368 HydrophobicContact CB-CB 3.69Å; L322-F368 HydrophobicContact CB-CD1 4.22Å; L322-F368 HydrophobicContact CB-CD2 3.68Å; L322-F368 HydrophobicContact CB-CE2 4.27Å; L322-F368 HydrophobicContact CB-CG 3.62Å; L322-F368 HydrophobicContact CD1-CD1 3.78Å; L322-F368 HydrophobicContact CD1-CD2 4.43Å; L322-F368 HydrophobicContact CD1-CE1 3.89Å; L322-F368 HydrophobicContact CD1-CE2 4.48Å; L322-F368 HydrophobicContact CD1-CG 4.07Å; L322-F368 HydrophobicContact CD1-CZ 4.23Å; L322-F368 HydrophobicContact CD2-CE2 4.44Å; L322-F368 HydrophobicContact CG-CD2 4.49Å; L322-F368 HydrophobicContact CG-CG 4.44Å; R324-F368 VanDerWaalsContact CA-O 3.32Å; R324-F368 WeakPolarHBondContact CA-O 3.27Å; R324-F368 WeakPolarHBondContact CB-O 3.28Å; V359-F368 HydrophobicContact CG1-CE2 4.35Å; V359-F368 HydrophobicContact CG1-CZ 3.93Å; F368-A384 HydrophobicContact CD1-CB 3.95Å; F368-A384 HydrophobicContact CE1-CB 3.84Å; F368-L385 WeakPolarHBondContact CA-O 3.17Å; F368-K386 HydrophobicContact CD1-CD 4.32Å; F368-K386 HydrophobicContact CD1-CG 3.56Å; F368-K386 HydrophobicContact CE1-CD 4.3Å; F368-K386 HydrophobicContact CE1-CG 3.89Å; F368-K386 HydrophobicContact CG-CG 4.08Å; F368-F401 HydrophobicContact CE1-CE1 4.03Å; F368-F401 HydrophobicContact CE1-CZ 4.27Å; F368-F401 HydrophobicContact CZ-CE1 4.18Å; F368-F401 HydrophobicContact CZ-CZ 4.26Å
369	S	98.8	Very high	97.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	-20.7	-176.6	59.1	0	0	0	0	114.4	E308 G367 L385 Y419	E308-S369 CarbonylContact O-C 3.47Å; G367-S369 PolarHBondContact O-N 2.88Å; S369-L385 PolarHBondContact N-O 3.47Å; S369-L385 WeakPolarHBondContact OG-CB 3.37Å; S369-Y419 PolarHBondContact OG-O 3.08Å
370	S	98.9	Very high	97.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	157.5	168.3	-172.1	0	0	0	0	109.4	D193 A384 L385 E420 L422	D193-S370 PolarHBondContact OD1-OG 2.89Å; S370-A384 CarbonylContact O-C 3.57Å; S370-A384 WeakPolarHBondContact O-CA 3.37Å; S370-L385 PolarHBondContact O-N 3.48Å; S370-E420 WeakPolarHBondContact CB-O 3.46Å; S370-L422 PolarHBondContact OG-N 2.91Å
371	F	98.9	Very high	98	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	159.8	166.3	78.2	-84.2	0	0	0	111.6	S309 A311 F320 L322 F373 I382 L383 A384	S309-F371 WeakPolarHBondContact OG-CD1 3.31Å; A311-F371 HydrophobicContact CB-CD2 4.42Å; A311-F371 HydrophobicContact CB-CE1 4.47Å; A311-F371 HydrophobicContact CB-CE2 3.52Å; A311-F371 HydrophobicContact CB-CZ 3.53Å; F320-F371 HydrophobicContact CB-CE2 4.17Å; F320-F371 HydrophobicContact CB-CZ 3.76Å; L322-F371 HydrophobicContact CB-CD1 4.1Å; L322-F371 HydrophobicContact CB-CE1 4.36Å; L322-F371 HydrophobicContact CD1-CB 3.7Å; L322-F371 HydrophobicContact CD1-CD1 3.57Å; L322-F371 HydrophobicContact CD1-CD2 4.35Å; L322-F371 HydrophobicContact CD1-CE1 4.3Å; L322-F371 HydrophobicContact CD1-CG 3.61Å; L322-F371 HydrophobicContact CG-CD1 3.6Å; L322-F371 HydrophobicContact CG-CE1 3.86Å; L322-F371 HydrophobicContact CG-CG 4.09Å; F371-F373 HydrophobicContact CE2-CE2 4.37Å; F371-F373 HydrophobicContact CE2-CZ 4.39Å; F371-I382 HydrophobicContact CB-CG2 3.8Å; F371-I382 HydrophobicContact CD2-CD1 4.07Å; F371-I382 HydrophobicContact CD2-CG1 4.17Å; F371-I382 HydrophobicContact CD2-CG2 3.7Å; F371-I382 HydrophobicContact CE2-CD1 4.08Å; F371-I382 HydrophobicContact CE2-CG1 4.49Å; F371-I382 HydrophobicContact CG-CG2 4.08Å; F371-L383 CarbonylContact C-O 3.59Å; F371-L383 VanDerWaalsContact CA-O 3.24Å; F371-L383 WeakPolarHBondContact CA-O 3.04Å; F371-L383 WeakPolarHBondContact CB-O 3.19Å; F371-A384 HydrophobicContact CB-CB 3.72Å
372	K	98.9	Very high	98.2	Very high	13 Å²	13	31.9 Å²	31.9	6%	0.057	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	152.1	169.7	-61.8	-67.1	-175.9	-65.6	0	109.9	D193 L194 L383 L422 E423 F424	D193-K372 IonicContact OD1-NZ 2.87Å; D193-K372 PolarHBondContact OD1-NZ 2.61Å; L194-K372 VanDerWaalsContact O-CE 3.31Å; L194-K372 WeakPolarHBondContact O-CE 3.31Å; L194-K372 PolarHBondContact O-NZ 2.8Å; K372-L383 PolarHBondContact N-O 2.72Å; K372-L383 PolarHBondContact O-N 3.19Å; K372-L422 VanDerWaalsContact CE-O 3.28Å; K372-L422 WeakPolarHBondContact CE-O 3.34Å; K372-L422 WeakPolarHBondContact CG-O 3.43Å; K372-L422 PolarHBondContact NZ-O 3.19Å; K372-E423 WeakPolarHBondContact CE-OE2 3.2Å; K372-F424 HydrophobicContact CB-CD2 4.1Å; K372-F424 HydrophobicContact CB-CE2 3.9Å
373	F	98.9	Very high	98.3	Very high	15 Å²	15	26.8 Å²	26.8	7%	0.066	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	139.2	166.8	-68.3	-70.2	0	0	0	109.6	A311 F320 F371 P375 D379 I381 I382 L403 F424	A311-F373 HydrophobicContact CB-CD2 4.24Å; A311-F373 HydrophobicContact CB-CE2 3.9Å; F320-F373 HydrophobicContact CB-CZ 4.17Å; F320-F373 HydrophobicContact CD1-CZ 4.2Å; F320-F373 HydrophobicContact CD2-CE2 4.04Å; F320-F373 AromaticContact CD2-CZ 3.55Å; F320-F373 HydrophobicContact CD2-CZ 3.55Å; F320-F373 HydrophobicContact CE1-CZ 4.47Å; F320-F373 AromaticContact CE2-CZ 3.87Å; F320-F373 HydrophobicContact CE2-CZ 3.87Å; F320-F373 HydrophobicContact CG-CE2 4.43Å; F320-F373 AromaticContact CG-CZ 3.72Å; F320-F373 HydrophobicContact CG-CZ 3.72Å; F320-F373 HydrophobicContact CZ-CZ 4.32Å; F371-F373 HydrophobicContact CE2-CE2 4.37Å; F371-F373 HydrophobicContact CE2-CZ 4.39Å; F373-P375 WeakPolarHBondContact O-CD 3.27Å; F373-D379 HydrophobicContact CB-CB 4.28Å; F373-D379 HydrophobicContact CD1-CB 3.65Å; F373-D379 WeakPolarHBondContact CD1-O 3.37Å; F373-D379 HydrophobicContact CD2-CB 4.19Å; F373-D379 HydrophobicContact CE1-CB 3.97Å; F373-D379 WeakPolarHBondContact CE1-O 3.44Å; F373-D379 HydrophobicContact CE2-CB 4.49Å; F373-D379 HydrophobicContact CG-CB 3.77Å; F373-D379 HydrophobicContact CZ-CB 4.38Å; F373-I381 WeakPolarHBondContact CA-O 3.38Å; F373-I382 HydrophobicContact CD1-CD1 4.35Å; F373-I382 HydrophobicContact CD1-CG1 3.61Å; F373-I382 HydrophobicContact CE1-CD1 3.76Å; F373-I382 HydrophobicContact CE1-CG1 3.54Å; F373-I382 HydrophobicContact CZ-CD1 4.34Å; F373-I382 HydrophobicContact CZ-CG1 4.43Å; F373-L403 HydrophobicContact CE1-CD2 4.24Å; F373-F424 VanDerWaalsContact O-CE2 3.26Å; F373-F424 WeakPolarHBondContact O-CE2 3.35Å
374	I	98.7	Very high	98.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-73	124.2	174.4	-51.5	-167.8	0	0	0	107.9	Y129 L158 V160 V167 T377 I381 L383 F424	Y129-I374 HydrophobicContact CE2-CG2 4.22Å; L158-I374 HydrophobicContact CD1-CD1 3.93Å; L158-I374 HydrophobicContact CD2-CD1 4.22Å; L158-I374 HydrophobicContact CD2-CG2 4.21Å; V160-I374 HydrophobicContact CG2-CD1 4.36Å; V160-I374 HydrophobicContact CG2-CG2 3.76Å; V167-I374 HydrophobicContact CG2-CD1 3.99Å; I374-T377 HydrophobicContact CB-CG2 3.89Å; I374-T377 HydrophobicContact CG2-CG2 4.01Å; I374-T377 WeakPolarHBondContact O-CB 3.38Å; I374-T377 WeakPolarHBondContact O-CG2 3.3Å; I374-T377 PolarHBondContact O-N 3.35Å; I374-T377 PolarHBondContact O-OG1 2.88Å; I374-I381 HydrophobicContact CB-CB 4.41Å; I374-I381 HydrophobicContact CD1-CB 4.23Å; I374-I381 HydrophobicContact CD1-CG2 3.51Å; I374-I381 HydrophobicContact CG1-CB 4.24Å; I374-I381 HydrophobicContact CG1-CG2 3.96Å; I374-I381 PolarHBondContact N-O 3.11Å; I374-L383 HydrophobicContact CD1-CB 4.43Å; I374-L383 HydrophobicContact CG1-CB 4.2Å; I374-F424 HydrophobicContact CB-CZ 4.21Å; I374-F424 HydrophobicContact CG1-CZ 4.07Å; I374-F424 HydrophobicContact CG2-CE1 4.4Å; I374-F424 HydrophobicContact CG2-CZ 4.11Å
375	P	98.5	Very high	98.4	Very high	13 Å²	13	21.8 Å²	21.8	8%	0.084	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	150.3	-177.7	-22.1	30	0	0	0	112	Y115 P116 Y129 F373 T377 F424	Y115-P375 HydrophobicContact CE1-CG 4.02Å; P116-P375 HydrophobicContact CG-CB 4.41Å; P116-P375 HydrophobicContact CG-CG 3.74Å; Y129-P375 HydrophobicContact CD1-CB 4.42Å; Y129-P375 HydrophobicContact CD1-CG 4.17Å; Y129-P375 HydrophobicContact CE1-CB 3.81Å; Y129-P375 HydrophobicContact CE1-CG 4.05Å; Y129-P375 PolarHBondContact OH-O 2.68Å; F373-P375 WeakPolarHBondContact O-CD 3.27Å; P375-T377 VanDerWaalsContact C-N 3.26Å; P375-T377 PolarHBondContact O-N 2.63Å; P375-F424 HydrophobicContact CG-CB 4.41Å; P375-F424 HydrophobicContact CG-CD1 4.32Å; P375-F424 HydrophobicContact CG-CD2 4.13Å; P375-F424 HydrophobicContact CG-CG 4.02Å
376	N	96.1	Very high	98.5	Very high	127 Å²	127	21.7 Å²	21.7	68%	0.679	11%	0.112	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	25.6	-179.4	-38.3	101.6	0	0	0	114.8	Y129	Y129-N376 PolarHBondContact OH-OD1 2.84Å
377	T	96.9	Very high	98.4	Very high	22 Å²	22	21 Å²	21	14%	0.135	11%	0.109	C	C	.	.	S	Bend	trans	-115.3	18.5	175.9	71.4	0	0	0	0	113.9	I374 P375 D379 Q380 I381	I374-T377 HydrophobicContact CB-CG2 3.89Å; I374-T377 HydrophobicContact CG2-CG2 4.01Å; I374-T377 WeakPolarHBondContact O-CB 3.38Å; I374-T377 WeakPolarHBondContact O-CG2 3.3Å; I374-T377 PolarHBondContact O-N 3.35Å; I374-T377 PolarHBondContact O-OG1 2.88Å; P375-T377 VanDerWaalsContact C-N 3.26Å; P375-T377 PolarHBondContact O-N 2.63Å; T377-D379 PolarHBondContact O-N 2.93Å; T377-Q380 VanDerWaalsContact O-CB 3.27Å; T377-Q380 WeakPolarHBondContact O-CB 3.21Å; T377-Q380 WeakPolarHBondContact O-CG 3.45Å; T377-Q380 PolarHBondContact O-N 3.47Å; T377-I381 HydrophobicContact CG2-CB 4.28Å; T377-I381 HydrophobicContact CG2-CD1 3.91Å; T377-I381 HydrophobicContact CG2-CG1 4.22Å; T377-I381 PolarHBondContact OG1-N 3.16Å
378	D	97.9	Very high	98.4	Very high	118 Å²	118	21.5 Å²	21.5	63%	0.631	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	34.9	-173.7	-55.2	-34.2	0	0	0	113	T315 Q380	T315-D378 HydrophobicContact CG2-CB 4.33Å; D378-Q380 HydrophobicContact CB-CG 4.3Å; D378-Q380 PolarHBondContact O-N 3.05Å; D378-Q380 VanDerWaalsContact O-N 3.1Å; D378-Q380 PolarHBondContact O-NE2 3.22Å
379	D	98.3	Very high	98.1	Very high	24 Å²	24	23.9 Å²	23.9	13%	0.128	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	24.7	-172.4	-56.3	-25.8	0	0	0	114.2	S313 T315 L316 F373 T377 L403	S313-D379 WeakPolarHBondContact CB-OD2 3.27Å; S313-D379 WeakPolarHBondContact OG-CB 3.38Å; S313-D379 PolarHBondContact OG-OD2 3.2Å; T315-D379 WeakPolarHBondContact CB-OD2 3.06Å; T315-D379 PolarHBondContact OG1-OD2 2.81Å; L316-D379 HydrophobicContact CD1-CB 3.92Å; L316-D379 HydrophobicContact CG-CB 4.22Å; F373-D379 HydrophobicContact CB-CB 4.28Å; F373-D379 HydrophobicContact CD1-CB 3.65Å; F373-D379 WeakPolarHBondContact CD1-O 3.37Å; F373-D379 HydrophobicContact CD2-CB 4.19Å; F373-D379 HydrophobicContact CE1-CB 3.97Å; F373-D379 WeakPolarHBondContact CE1-O 3.44Å; F373-D379 HydrophobicContact CE2-CB 4.49Å; F373-D379 HydrophobicContact CG-CB 3.77Å; F373-D379 HydrophobicContact CZ-CB 4.38Å; T377-D379 PolarHBondContact O-N 2.93Å; D379-L403 WeakPolarHBondContact O-CD1 3.21Å
380	Q	97.9	Very high	97.7	Very high	82 Å²	82	25.4 Å²	25.4	38%	0.383	13%	0.131	S	C	.	.			trans	-86.2	-17.7	179.5	-59.5	-51.1	-66.8	0	0	113.8	T377 D378 T402 L403	T377-Q380 VanDerWaalsContact O-CB 3.27Å; T377-Q380 WeakPolarHBondContact O-CB 3.21Å; T377-Q380 WeakPolarHBondContact O-CG 3.45Å; T377-Q380 PolarHBondContact O-N 3.47Å; D378-Q380 HydrophobicContact CB-CG 4.3Å; D378-Q380 PolarHBondContact O-N 3.05Å; D378-Q380 VanDerWaalsContact O-N 3.1Å; D378-Q380 PolarHBondContact O-NE2 3.22Å; Q380-T402 CarbonylContact O-C 3.24Å; Q380-T402 WeakPolarHBondContact O-CA 3.35Å; Q380-L403 PolarHBondContact O-N 3.23Å
381	I	98.4	Very high	97.2	Very high	14 Å²	14	29.6 Å²	29.6	7%	0.072	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.4	179.9	-49.2	179.4	0	0	0	109.7	F373 I374 T377 T402 L408	F373-I381 WeakPolarHBondContact CA-O 3.38Å; I374-I381 HydrophobicContact CB-CB 4.41Å; I374-I381 HydrophobicContact CD1-CB 4.23Å; I374-I381 HydrophobicContact CD1-CG2 3.51Å; I374-I381 HydrophobicContact CG1-CB 4.24Å; I374-I381 HydrophobicContact CG1-CG2 3.96Å; I374-I381 PolarHBondContact N-O 3.11Å; T377-I381 HydrophobicContact CG2-CB 4.28Å; T377-I381 HydrophobicContact CG2-CD1 3.91Å; T377-I381 HydrophobicContact CG2-CG1 4.22Å; T377-I381 PolarHBondContact OG1-N 3.16Å; I381-T402 HydrophobicContact CG1-CG2 4.17Å; I381-L408 HydrophobicContact CD1-CD1 3.76Å; I381-L408 HydrophobicContact CG1-CD1 4.16Å; I381-L408 HydrophobicContact CG2-CD1 3.64Å
382	I	98.8	Very high	96.7	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.5	175.4	-71.9	172.6	0	0	0	109.4	L322 F371 F373 A384 A400 F401 L403	L322-I382 HydrophobicContact CD1-CG2 4.41Å; F371-I382 HydrophobicContact CB-CG2 3.8Å; F371-I382 HydrophobicContact CD2-CD1 4.07Å; F371-I382 HydrophobicContact CD2-CG1 4.17Å; F371-I382 HydrophobicContact CD2-CG2 3.7Å; F371-I382 HydrophobicContact CE2-CD1 4.08Å; F371-I382 HydrophobicContact CE2-CG1 4.49Å; F371-I382 HydrophobicContact CG-CG2 4.08Å; F373-I382 HydrophobicContact CD1-CD1 4.35Å; F373-I382 HydrophobicContact CD1-CG1 3.61Å; F373-I382 HydrophobicContact CE1-CD1 3.76Å; F373-I382 HydrophobicContact CE1-CG1 3.54Å; F373-I382 HydrophobicContact CZ-CD1 4.34Å; F373-I382 HydrophobicContact CZ-CG1 4.43Å; I382-A384 HydrophobicContact CG2-CB 4.09Å; I382-A400 CarbonylContact O-C 3.6Å; I382-A400 WeakPolarHBondContact O-CA 2.99Å; I382-A400 WeakPolarHBondContact O-CB 3.2Å; I382-F401 HydrophobicContact CB-CD2 4.04Å; I382-F401 HydrophobicContact CB-CE2 3.7Å; I382-F401 HydrophobicContact CB-CZ 4.16Å; I382-F401 HydrophobicContact CD1-CE2 3.99Å; I382-F401 HydrophobicContact CG1-CE2 4.4Å; I382-F401 HydrophobicContact CG2-CD2 4.46Å; I382-F401 HydrophobicContact CG2-CE1 4.36Å; I382-F401 HydrophobicContact CG2-CE2 3.76Å; I382-F401 HydrophobicContact CG2-CZ 3.7Å; I382-F401 PolarHBondContact N-O 2.9Å; I382-F401 PolarHBondContact O-N 3.47Å; I382-L403 HydrophobicContact CD1-CD2 3.72Å; I382-L403 HydrophobicContact CG1-CD2 4.44Å
383	L	98.9	Very high	96.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	129.1	159.3	-177	73.3	0	0	0	107.8	L158 F371 K372 I374 I398 A400 L422 F424	L158-L383 HydrophobicContact CD1-CB 4.29Å; L158-L383 HydrophobicContact CD1-CD1 3.62Å; L158-L383 HydrophobicContact CD1-CD2 3.54Å; L158-L383 HydrophobicContact CD1-CG 4.01Å; F371-L383 CarbonylContact C-O 3.59Å; F371-L383 VanDerWaalsContact CA-O 3.24Å; F371-L383 WeakPolarHBondContact CA-O 3.04Å; F371-L383 WeakPolarHBondContact CB-O 3.19Å; K372-L383 PolarHBondContact N-O 2.72Å; K372-L383 PolarHBondContact O-N 3.19Å; I374-L383 HydrophobicContact CD1-CB 4.43Å; I374-L383 HydrophobicContact CG1-CB 4.2Å; L383-I398 HydrophobicContact CD1-CD1 3.93Å; L383-I398 HydrophobicContact CD1-CG1 3.83Å; L383-I398 HydrophobicContact CD2-CD1 4.27Å; L383-I398 HydrophobicContact CG-CD1 4.25Å; L383-I398 HydrophobicContact CG-CG1 4.35Å; L383-A400 HydrophobicContact CD1-CB 3.94Å; L383-L422 HydrophobicContact CB-CD2 4.18Å; L383-L422 HydrophobicContact CD2-CD1 3.77Å; L383-L422 HydrophobicContact CD2-CD2 3.74Å; L383-L422 HydrophobicContact CD2-CG 4.21Å; L383-L422 HydrophobicContact CG-CD2 3.7Å; L383-L422 WeakPolarHBondContact O-CD2 3.26Å; L383-F424 HydrophobicContact CB-CZ 4.46Å; L383-F424 HydrophobicContact CD2-CZ 4.13Å
384	A	98.9	Very high	96.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.7	-175.4	0	0	0	0	0	112.6	L322 F368 S370 F371 I382 I398 T399 F401	L322-A384 HydrophobicContact CD1-CB 3.93Å; F368-A384 HydrophobicContact CD1-CB 3.95Å; F368-A384 HydrophobicContact CE1-CB 3.84Å; S370-A384 CarbonylContact O-C 3.57Å; S370-A384 WeakPolarHBondContact O-CA 3.37Å; F371-A384 HydrophobicContact CB-CB 3.72Å; I382-A384 HydrophobicContact CG2-CB 4.09Å; A384-I398 WeakPolarHBondContact O-CA 3.39Å; A384-T399 HydrophobicContact CB-CG2 4.35Å; A384-T399 PolarHBondContact N-O 3.13Å; A384-T399 PolarHBondContact O-N 2.89Å; A384-F401 HydrophobicContact CB-CE1 3.9Å; A384-F401 HydrophobicContact CB-CZ 4.16Å
385	L	98.9	Very high	96.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	148.7	167.4	-61.3	-176.5	0	0	0	110.7	V133 F368 S369 S370 T396 Y397 I398 I414 Y419 L422	V133-L385 HydrophobicContact CB-CD1 4.33Å; V133-L385 HydrophobicContact CG1-CD1 3.91Å; V133-L385 HydrophobicContact CG1-CD2 4.21Å; F368-L385 WeakPolarHBondContact CA-O 3.17Å; S369-L385 PolarHBondContact N-O 3.47Å; S369-L385 WeakPolarHBondContact OG-CB 3.37Å; S370-L385 PolarHBondContact O-N 3.48Å; L385-T396 HydrophobicContact CB-CG2 4.36Å; L385-T396 HydrophobicContact CD2-CG2 4.4Å; L385-Y397 CarbonylContact C-O 3.57Å; L385-Y397 VanDerWaalsContact CA-O 3.3Å; L385-Y397 WeakPolarHBondContact CA-O 3.43Å; L385-I398 HydrophobicContact CD2-CB 4.01Å; L385-I398 HydrophobicContact CD2-CD1 4.03Å; L385-I398 HydrophobicContact CD2-CG1 3.91Å; L385-I414 HydrophobicContact CD2-CD1 3.76Å; L385-Y419 WeakPolarHBondContact CD1-O 3.02Å; L385-L422 HydrophobicContact CD1-CB 3.85Å; L385-L422 HydrophobicContact CG-CB 3.93Å; L385-L422 HydrophobicContact CG-CD2 4.18Å
386	K	98.8	Very high	96.3	Very high	9 Å²	9	38.5 Å²	38.5	4%	0.039	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	130.6	160.3	-61.8	-172.8	-166.6	160.1	0	110	H366 G367 F368 T396 Y397 E411	H366-K386 HydrophobicContact CB-CB 4.21Å; H366-K386 HydrophobicContact CB-CD 3.83Å; G367-K386 CarbonylContact O-C 3.56Å; G367-K386 WeakPolarHBondContact O-CA 3.31Å; G367-K386 VanDerWaalsContact O-CB 3.3Å; G367-K386 WeakPolarHBondContact O-CB 3.16Å; F368-K386 HydrophobicContact CD1-CD 4.32Å; F368-K386 HydrophobicContact CD1-CG 3.56Å; F368-K386 HydrophobicContact CE1-CD 4.3Å; F368-K386 HydrophobicContact CE1-CG 3.89Å; F368-K386 HydrophobicContact CG-CG 4.08Å; K386-T396 CarbonylContact O-C 3.44Å; K386-T396 WeakPolarHBondContact O-CA 3.2Å; K386-T396 WeakPolarHBondContact O-CG2 3.32Å; K386-Y397 PolarHBondContact N-O 3.33Å; K386-Y397 PolarHBondContact O-N 3.45Å; K386-E411 WeakPolarHBondContact CD-OE1 3.45Å; K386-E411 IonicContact NZ-OE1 3.31Å; K386-E411 IonicContact NZ-OE2 2.67Å; K386-E411 PolarHBondContact NZ-OE2 2.96Å
387	S	97.8	Very high	96.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	149.5	166.5	56.5	0	0	0	0	111.3	R324 G367 A395	R324-S387 PolarHBondContact NH1-OG 3.3Å; R324-S387 PolarHBondContact NH2-OG 3.5Å; G367-S387 PolarHBondContact N-O 3.17Å; G367-S387 PolarHBondContact O-N 2.71Å; S387-A395 CarbonylContact C-O 3.59Å; S387-A395 WeakPolarHBondContact CA-O 3.37Å
388	E	97.7	Very high	96.6	Very high	11 Å²	11	32.5 Å²	32.5	5%	0.051	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.1	174.5	-179.8	177.5	-133.2	0	0	109.2	T365 H366 D390 K393 I394 A395 Y397	T365-E388 VanDerWaalsContact CB-OE1 3.29Å; T365-E388 WeakPolarHBondContact CB-OE1 3.41Å; T365-E388 PolarHBondContact OG1-OE1 2.92Å; H366-E388 IonicContact CD2-OE1 2.74Å; H366-E388 PolarHBondContact CD2-OE1 2.77Å; H366-E388 IonicContact NE2-OE1 3.68Å; H366-E388 PolarHBondContact NE2-OE1 2.98Å; H366-E388 IonicContact NE2-OE2 3.24Å; E388-D390 HydrophobicContact CG-CB 4.47Å; E388-K393 WeakPolarHBondContact OE2-CD 3.44Å; E388-K393 VanDerWaalsContact OE2-CE 3.31Å; E388-K393 WeakPolarHBondContact OE2-CE 3.36Å; E388-K393 IonicContact OE2-NZ 2.71Å; E388-K393 PolarHBondContact OE2-NZ 3.05Å; E388-I394 WeakPolarHBondContact O-CA 3.41Å; E388-A395 HydrophobicContact CB-CB 4.41Å; E388-A395 PolarHBondContact N-O 2.92Å; E388-A395 PolarHBondContact O-N 3.07Å; E388-Y397 HydrophobicContact CB-CE2 4.14Å
389	E	92.8	Very high	96.6	Very high	52 Å²	52	27.4 Å²	27.4	24%	0.243	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	108.6	165.9	-66.2	163.4	-68.6	0	0	105.8	R324 R325 E337 K393 K418	R324-E389 IonicContact CZ-OE1 2.61Å; R324-E389 IonicContact NE-OE1 3.64Å; R324-E389 IonicContact NH2-OE1 2.7Å; R324-E389 PolarHBondContact NH2-OE1 3.48Å; R325-E389 IonicContact NH2-OE1 3.2Å; E337-E389 WeakPolarHBondContact CB-O 3.21Å; E389-K393 WeakPolarHBondContact CA-O 3.3Å; E389-K418 HydrophobicContact CG-CD 4.06Å; E389-K418 IonicContact OE2-NZ 3.19Å
390	D	91.3	Very high	96.6	Very high	33 Å²	33	26.3 Å²	26.3	18%	0.176	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	111.4	174.9	-175.9	18.1	0	0	0	109.7	R338 T365 E388 G392 K393	R338-D390 IonicContact CZ-OD1 3.27Å; R338-D390 IonicContact CZ-OD2 3.89Å; R338-D390 VanDerWaalsContact CZ-OD2 3.29Å; R338-D390 IonicContact NE-OD1 3.78Å; R338-D390 IonicContact NH1-OD2 2.72Å; R338-D390 PolarHBondContact NH1-OD2 2.96Å; R338-D390 IonicContact NH2-OD1 3.19Å; R338-D390 PolarHBondContact NH2-OD1 2.95Å; R338-D390 IonicContact NH2-OD2 2.67Å; R338-D390 PolarHBondContact NH2-OD2 3.33Å; T365-D390 HydrophobicContact CG2-CB 3.82Å; E388-D390 HydrophobicContact CG-CB 4.47Å; D390-G392 PolarHBondContact O-N 3.04Å; D390-G392 VanDerWaalsContact O-N 3.09Å; D390-K393 PolarHBondContact N-O 3.45Å; D390-K393 VanDerWaalsContact N-O 3.15Å; D390-K393 WeakPolarHBondContact O-CB 3.38Å; D390-K393 PolarHBondContact O-N 3.02Å
391	A	88.4	Confident	96.7	Very high	88 Å²	88	22.6 Å²	22.6	73%	0.727	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	36.1	179.4	0	0	0	0	0	114.3	E337	E337-A391 PolarHBondContact OE2-N 2.8Å
392	G	88.3	Confident	96.6	Very high	71 Å²	71	22.4 Å²	22.4	73%	0.732	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.8	0.4	-178.9	0	0	0	0	0	115.8	D390	D390-G392 PolarHBondContact O-N 3.04Å; D390-G392 VanDerWaalsContact O-N 3.09Å
393	K	93.4	Very high	96.5	Very high	102 Å²	102	24.3 Å²	24.3	44%	0.443	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	128.3	161.1	-173	-163.5	173.3	-150.3	0	108.1	E388 E389 D390 Y397	E388-K393 WeakPolarHBondContact OE2-CD 3.44Å; E388-K393 VanDerWaalsContact OE2-CE 3.31Å; E388-K393 WeakPolarHBondContact OE2-CE 3.36Å; E388-K393 IonicContact OE2-NZ 2.71Å; E388-K393 PolarHBondContact OE2-NZ 3.05Å; E389-K393 WeakPolarHBondContact CA-O 3.3Å; D390-K393 PolarHBondContact N-O 3.45Å; D390-K393 VanDerWaalsContact N-O 3.15Å; D390-K393 WeakPolarHBondContact O-CB 3.38Å; D390-K393 PolarHBondContact O-N 3.02Å; K393-Y397 PolarHBondContact NZ-OH 3.18Å
394	I	96.9	Very high	96.2	Very high	55 Å²	55	30.8 Å²	30.8	28%	0.282	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.6	173	-58.9	177	0	0	0	108.8	E388 K418	E388-I394 WeakPolarHBondContact O-CA 3.41Å; I394-K418 HydrophobicContact CG2-CG 3.66Å
395	A	98.3	Very high	96	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	161.5	170.5	0	0	0	0	0	111	S387 E388 Y397 G415	S387-A395 CarbonylContact C-O 3.59Å; S387-A395 WeakPolarHBondContact CA-O 3.37Å; E388-A395 HydrophobicContact CB-CB 4.41Å; E388-A395 PolarHBondContact N-O 2.92Å; E388-A395 PolarHBondContact O-N 3.07Å; A395-Y397 HydrophobicContact CB-CE2 3.7Å; A395-Y397 WeakPolarHBondContact CB-OH 3.32Å; A395-G415 CarbonylContact C-O 3.51Å; A395-G415 VanDerWaalsContact CA-O 3.3Å; A395-G415 WeakPolarHBondContact CA-O 3.48Å
396	T	98.7	Very high	95.8	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.9	167.6	-59.1	0	0	0	0	111.7	L385 K386 I414 G415 V417 K418 Y419	L385-T396 HydrophobicContact CB-CG2 4.36Å; L385-T396 HydrophobicContact CD2-CG2 4.4Å; K386-T396 CarbonylContact O-C 3.44Å; K386-T396 WeakPolarHBondContact O-CA 3.2Å; K386-T396 WeakPolarHBondContact O-CG2 3.32Å; T396-I414 HydrophobicContact CG2-CD1 4.05Å; T396-I414 HydrophobicContact CG2-CG1 4Å; T396-I414 WeakPolarHBondContact O-CG1 3.21Å; T396-I414 PolarHBondContact O-N 3.27Å; T396-G415 PolarHBondContact N-O 3.33Å; T396-V417 WeakPolarHBondContact CB-O 3.49Å; T396-V417 PolarHBondContact OG1-O 2.95Å; T396-K418 VanDerWaalsContact OG1-CA 3.3Å; T396-K418 WeakPolarHBondContact OG1-CA 3.27Å; T396-Y419 HydrophobicContact CG2-CD2 4.28Å; T396-Y419 PolarHBondContact OG1-N 3.4Å
397	Y	98.8	Very high	95.7	Very high	21 Å²	21	40.4 Å²	40.4	8%	0.082	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.6	-177.7	-56.1	-88.8	0	0	0	110.7	H366 L385 K386 E388 K393 A395 E411 T412 E413	H366-Y397 AromaticContact CE1-CD2 3.51Å; H366-Y397 AromaticContact CE1-CE2 3.21Å; H366-Y397 WeakPolarHBondContact CE1-CE2 3.43Å; H366-Y397 AromaticContact CE1-CZ 3.56Å; H366-Y397 AromaticContact ND1-CD2 3.53Å; H366-Y397 AromaticContact ND1-CE2 3.7Å; H366-Y397 AromaticContact NE2-CE2 3.54Å; H366-Y397 AromaticContact NE2-CZ 3.95Å; L385-Y397 CarbonylContact C-O 3.57Å; L385-Y397 VanDerWaalsContact CA-O 3.3Å; L385-Y397 WeakPolarHBondContact CA-O 3.43Å; K386-Y397 PolarHBondContact N-O 3.33Å; K386-Y397 PolarHBondContact O-N 3.45Å; E388-Y397 HydrophobicContact CB-CE2 4.14Å; K393-Y397 PolarHBondContact NZ-OH 3.18Å; A395-Y397 HydrophobicContact CB-CE2 3.7Å; A395-Y397 WeakPolarHBondContact CB-OH 3.32Å; Y397-E411 HydrophobicContact CD1-CG 4.2Å; Y397-E411 HydrophobicContact CG-CG 4Å; Y397-T412 CarbonylContact C-O 3.59Å; Y397-T412 VanDerWaalsContact CA-O 3.26Å; Y397-T412 WeakPolarHBondContact CA-O 3.05Å; Y397-E413 HydrophobicContact CD1-CB 3.79Å; Y397-E413 HydrophobicContact CD1-CG 4.09Å; Y397-E413 HydrophobicContact CE1-CB 3.55Å; Y397-E413 HydrophobicContact CE1-CG 3.58Å; Y397-E413 VanDerWaalsContact CE1-OE2 3.27Å; Y397-E413 WeakPolarHBondContact CE1-OE2 3.18Å; Y397-E413 PolarHBondContact OH-OE2 3.13Å
398	I	98.9	Very high	95.8	Very high	2 Å²	2	41 Å²	41	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.8	172	-163.3	159.7	0	0	0	110.4	V169 W171 L383 A384 L385 L409 E411 T412 I414	V169-I398 HydrophobicContact CG1-CD1 4.49Å; V169-I398 HydrophobicContact CG2-CD1 4.21Å; W171-I398 HydrophobicContact CH2-CD1 4.23Å; W171-I398 HydrophobicContact CZ2-CD1 3.92Å; L383-I398 HydrophobicContact CD1-CD1 3.93Å; L383-I398 HydrophobicContact CD1-CG1 3.83Å; L383-I398 HydrophobicContact CD2-CD1 4.27Å; L383-I398 HydrophobicContact CG-CD1 4.25Å; L383-I398 HydrophobicContact CG-CG1 4.35Å; A384-I398 WeakPolarHBondContact O-CA 3.39Å; L385-I398 HydrophobicContact CD2-CB 4.01Å; L385-I398 HydrophobicContact CD2-CD1 4.03Å; L385-I398 HydrophobicContact CD2-CG1 3.91Å; I398-L409 HydrophobicContact CG2-CD2 4.23Å; I398-E411 WeakPolarHBondContact O-CA 3.36Å; I398-T412 PolarHBondContact N-O 3.12Å; I398-T412 PolarHBondContact O-N 3.46Å; I398-I414 HydrophobicContact CB-CG2 3.9Å; I398-I414 HydrophobicContact CG2-CG2 3.46Å; I398-I414 VanDerWaalsContact CG2-CG2 3.46Å
399	T	98.8	Very high	95.8	Very high	11 Å²	11	41.5 Å²	41.5	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.8	175.3	-175.4	0	0	0	0	110.2	A384 F401 L409	A384-T399 HydrophobicContact CB-CG2 4.35Å; A384-T399 PolarHBondContact N-O 3.13Å; A384-T399 PolarHBondContact O-N 2.89Å; T399-F401 HydrophobicContact CG2-CD1 4.09Å; T399-F401 HydrophobicContact CG2-CE1 3.97Å; T399-L409 WeakPolarHBondContact CA-O 3.3Å; T399-L409 PolarHBondContact OG1-O 2.89Å
400	A	98.7	Very high	96	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	143.1	172.6	0	0	0	0	0	110.7	V167 I382 L383 L408 L409	V167-A400 HydrophobicContact CB-CB 3.87Å; V167-A400 HydrophobicContact CG1-CB 3.83Å; V167-A400 HydrophobicContact CG2-CB 3.96Å; I382-A400 CarbonylContact O-C 3.6Å; I382-A400 WeakPolarHBondContact O-CA 2.99Å; I382-A400 WeakPolarHBondContact O-CB 3.2Å; L383-A400 HydrophobicContact CD1-CB 3.94Å; A400-L408 PolarHBondContact O-N 3.44Å; A400-L409 HydrophobicContact CB-CB 3.81Å; A400-L409 PolarHBondContact N-O 3.35Å; A400-L409 VanDerWaalsContact N-O 3.13Å; A400-L409 PolarHBondContact O-N 2.97Å
401	F	98.6	Very high	96.3	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	158.4	-172.6	50.3	-103	0	0	0	112	L322 V359 F368 I382 A384 T399 R406	L322-F401 HydrophobicContact CD1-CZ 3.86Å; L322-F401 HydrophobicContact CD2-CZ 4.47Å; V359-F401 HydrophobicContact CB-CD2 4.33Å; V359-F401 HydrophobicContact CB-CE2 4.35Å; V359-F401 HydrophobicContact CG1-CD2 4.48Å; V359-F401 HydrophobicContact CG1-CE1 4.19Å; V359-F401 HydrophobicContact CG1-CE2 4.05Å; V359-F401 HydrophobicContact CG1-CZ 3.89Å; V359-F401 HydrophobicContact CG2-CB 3.67Å; V359-F401 HydrophobicContact CG2-CD1 3.67Å; V359-F401 HydrophobicContact CG2-CD2 3.57Å; V359-F401 HydrophobicContact CG2-CE1 4.1Å; V359-F401 HydrophobicContact CG2-CE2 3.99Å; V359-F401 HydrophobicContact CG2-CG 3.37Å; V359-F401 HydrophobicContact CG2-CZ 4.24Å; F368-F401 HydrophobicContact CE1-CE1 4.03Å; F368-F401 HydrophobicContact CE1-CZ 4.27Å; F368-F401 HydrophobicContact CZ-CE1 4.18Å; F368-F401 HydrophobicContact CZ-CZ 4.26Å; I382-F401 HydrophobicContact CB-CD2 4.04Å; I382-F401 HydrophobicContact CB-CE2 3.7Å; I382-F401 HydrophobicContact CB-CZ 4.16Å; I382-F401 HydrophobicContact CD1-CE2 3.99Å; I382-F401 HydrophobicContact CG1-CE2 4.4Å; I382-F401 HydrophobicContact CG2-CD2 4.46Å; I382-F401 HydrophobicContact CG2-CE1 4.36Å; I382-F401 HydrophobicContact CG2-CE2 3.76Å; I382-F401 HydrophobicContact CG2-CZ 3.7Å; I382-F401 PolarHBondContact N-O 2.9Å; I382-F401 PolarHBondContact O-N 3.47Å; A384-F401 HydrophobicContact CB-CE1 3.9Å; A384-F401 HydrophobicContact CB-CZ 4.16Å; T399-F401 HydrophobicContact CG2-CD1 4.09Å; T399-F401 HydrophobicContact CG2-CE1 3.97Å; F401-R406 VanDerWaalsContact CA-O 3.29Å; F401-R406 WeakPolarHBondContact CA-O 3.4Å
402	T	97.7	Very high	96.8	Very high	11 Å²	11	43.4 Å²	43.4	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	162.4	171.1	51.1	0	0	0	0	112.4	Q380 I381 D404 G405 R406 L408	Q380-T402 CarbonylContact O-C 3.24Å; Q380-T402 WeakPolarHBondContact O-CA 3.35Å; I381-T402 HydrophobicContact CG1-CG2 4.17Å; T402-D404 WeakPolarHBondContact CB-OD1 3.49Å; T402-D404 PolarHBondContact O-N 2.88Å; T402-D404 PolarHBondContact OG1-OD1 2.96Å; T402-G405 WeakPolarHBondContact O-CA 3.38Å; T402-G405 PolarHBondContact O-N 3.25Å; T402-R406 PolarHBondContact N-O 3.33Å; T402-R406 VanDerWaalsContact OG1-CB 3.29Å; T402-R406 WeakPolarHBondContact OG1-CB 3.26Å; T402-R406 PolarHBondContact OG1-N 3.38Å; T402-R406 VanDerWaalsContact OG1-N 3.15Å; T402-R406 PolarHBondContact OG1-O 2.97Å; T402-L408 HydrophobicContact CG2-CD1 4.17Å; T402-L408 HydrophobicContact CG2-CD2 4.3Å; T402-L408 HydrophobicContact CG2-CG 4.44Å
403	L	95.3	Very high	97.3	Very high	40 Å²	40	45.5 Å²	45.5	21%	0.209	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.5	177.2	-72.7	-176.3	0	0	0	114.9	L316 F320 F373 D379 Q380 I382 G405	L316-L403 HydrophobicContact CD1-CD1 3.63Å; F320-L403 HydrophobicContact CD1-CD2 4.17Å; F320-L403 HydrophobicContact CE1-CD1 4.1Å; F320-L403 HydrophobicContact CE1-CD2 3.7Å; F320-L403 HydrophobicContact CZ-CD1 4.13Å; F320-L403 HydrophobicContact CZ-CD2 4.45Å; F373-L403 HydrophobicContact CE1-CD2 4.24Å; D379-L403 WeakPolarHBondContact O-CD1 3.21Å; Q380-L403 PolarHBondContact O-N 3.23Å; I382-L403 HydrophobicContact CD1-CD2 3.72Å; I382-L403 HydrophobicContact CG1-CD2 4.44Å; L403-G405 VanDerWaalsContact C-N 3.26Å
404	D	94.1	Very high	97.5	Very high	136 Å²	136	41.1 Å²	41.1	73%	0.727	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	1.9	171.5	70.5	-35.1	0	0	0	113.5	T402	T402-D404 WeakPolarHBondContact CB-OD1 3.49Å; T402-D404 PolarHBondContact O-N 2.88Å; T402-D404 PolarHBondContact OG1-OD1 2.96Å
405	G	93.3	Very high	97.5	Very high	18 Å²	18	39.2 Å²	39.2	19%	0.186	21%	0.21	C	C	.	.			trans	93.4	6.3	170.2	0	0	0	0	0	115.7	T402 L403 V407	T402-G405 WeakPolarHBondContact O-CA 3.38Å; T402-G405 PolarHBondContact O-N 3.25Å; L403-G405 VanDerWaalsContact C-N 3.26Å; G405-V407 PolarHBondContact O-N 2.99Å
406	R	95.8	Very high	97.4	Very high	134 Å²	134	45 Å²	45	51%	0.506	24%	0.241	S	C	.	.			trans	-74.8	113.9	176.5	-177.7	-172.9	68.8	178.8	5.6	110.2	F401 T402 L408	F401-R406 VanDerWaalsContact CA-O 3.29Å; F401-R406 WeakPolarHBondContact CA-O 3.4Å; T402-R406 PolarHBondContact N-O 3.33Å; T402-R406 VanDerWaalsContact OG1-CB 3.29Å; T402-R406 WeakPolarHBondContact OG1-CB 3.26Å; T402-R406 PolarHBondContact OG1-N 3.38Å; T402-R406 VanDerWaalsContact OG1-N 3.15Å; T402-R406 PolarHBondContact OG1-O 2.97Å; R406-L408 HydrophobicContact CG-CD2 4.3Å; R406-L408 PolarHBondContact O-N 3.48Å
407	V	97.4	Very high	97.3	Very high	59 Å²	59	46 Å²	46	36%	0.358	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.2	177.8	-179.6	0	0	0	0	110.6	G405 L409	G405-V407 PolarHBondContact O-N 2.99Å; V407-L409 WeakPolarHBondContact CG1-O 3.33Å
408	L	98.1	Very high	97.3	Very high	12 Å²	12	45.5 Å²	45.5	6%	0.063	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-23.1	177.4	-47.6	-174.6	0	0	0	112.6	V167 I381 A400 T402 R406	V167-L408 HydrophobicContact CB-CB 4.32Å; V167-L408 HydrophobicContact CG2-CB 3.96Å; V167-L408 HydrophobicContact CG2-CD1 4.14Å; V167-L408 PolarHBondContact N-O 2.89Å; V167-L408 VanDerWaalsContact N-O 3.15Å; I381-L408 HydrophobicContact CD1-CD1 3.76Å; I381-L408 HydrophobicContact CG1-CD1 4.16Å; I381-L408 HydrophobicContact CG2-CD1 3.64Å; A400-L408 PolarHBondContact O-N 3.44Å; T402-L408 HydrophobicContact CG2-CD1 4.17Å; T402-L408 HydrophobicContact CG2-CD2 4.3Å; T402-L408 HydrophobicContact CG2-CG 4.44Å; R406-L408 HydrophobicContact CG-CD2 4.3Å; R406-L408 PolarHBondContact O-N 3.48Å
409	L	98.2	Very high	97.3	Very high	21 Å²	21	45.4 Å²	45.4	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	110.3	169.8	170.2	61.5	0	0	0	108.1	V167 V169 I398 T399 A400 V407	V167-L409 HydrophobicContact CB-CB 4.03Å; V167-L409 HydrophobicContact CG1-CB 4.28Å; V167-L409 HydrophobicContact CG1-CD2 4.26Å; V169-L409 HydrophobicContact CG2-CD2 3.82Å; I398-L409 HydrophobicContact CG2-CD2 4.23Å; T399-L409 WeakPolarHBondContact CA-O 3.3Å; T399-L409 PolarHBondContact OG1-O 2.89Å; A400-L409 HydrophobicContact CB-CB 3.81Å; A400-L409 PolarHBondContact N-O 3.35Å; A400-L409 VanDerWaalsContact N-O 3.13Å; A400-L409 PolarHBondContact O-N 2.97Å; V407-L409 WeakPolarHBondContact CG1-O 3.33Å
410	P	97.3	Very high	97.3	Very high	88 Å²	88	45.2 Å²	45.2	57%	0.571	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-55.3	152	172.6	-25.7	35.4	0	0	0	112.3	T412	P410-T412 PolarHBondContact O-N 2.92Å; P410-T412 VanDerWaalsContact O-N 3.09Å; P410-T412 PolarHBondContact O-OG1 3.29Å
411	E	97.9	Very high	97.3	Very high	58 Å²	58	45.2 Å²	45.2	27%	0.271	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	114.8	178.4	-168	162.8	174.7	0	0	110.9	H366 K386 Y397 I398	H366-E411 IonicContact CE1-OE1 3.46Å; H366-E411 IonicContact CG-OE1 3.07Å; H366-E411 IonicContact ND1-OE1 3.68Å; H366-E411 PolarHBondContact ND1-OE1 3.44Å; K386-E411 WeakPolarHBondContact CD-OE1 3.45Å; K386-E411 IonicContact NZ-OE1 3.31Å; K386-E411 IonicContact NZ-OE2 2.67Å; K386-E411 PolarHBondContact NZ-OE2 2.96Å; Y397-E411 HydrophobicContact CD1-CG 4.2Å; Y397-E411 HydrophobicContact CG-CG 4Å; I398-E411 WeakPolarHBondContact O-CA 3.36Å
412	T	98.3	Very high	97.3	Very high	67 Å²	67	45 Å²	45	41%	0.411	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.7	-170.9	-58.5	0	0	0	0	109.4	Y397 I398 P410	Y397-T412 CarbonylContact C-O 3.59Å; Y397-T412 VanDerWaalsContact CA-O 3.26Å; Y397-T412 WeakPolarHBondContact CA-O 3.05Å; I398-T412 PolarHBondContact N-O 3.12Å; I398-T412 PolarHBondContact O-N 3.46Å; P410-T412 PolarHBondContact O-N 2.92Å; P410-T412 VanDerWaalsContact O-N 3.09Å; P410-T412 PolarHBondContact O-OG1 3.29Å
413	E	98.4	Very high	97.4	Very high	116 Å²	116	44.7 Å²	44.7	54%	0.542	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	135.9	-179	-159.2	170.2	108.3	0	0	111.6	Y397	Y397-E413 HydrophobicContact CD1-CB 3.79Å; Y397-E413 HydrophobicContact CD1-CG 4.09Å; Y397-E413 HydrophobicContact CE1-CB 3.55Å; Y397-E413 HydrophobicContact CE1-CG 3.58Å; Y397-E413 VanDerWaalsContact CE1-OE2 3.27Å; Y397-E413 WeakPolarHBondContact CE1-OE2 3.18Å; Y397-E413 PolarHBondContact OH-OE2 3.13Å
414	I	98.3	Very high	97.6	Very high	10 Å²	10	42.8 Å²	42.8	5%	0.051	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	-3.4	-178.9	66.6	163	0	0	0	113.8	V133 R154 W171 L385 T396 I398 Y419	V133-I414 HydrophobicContact CG2-CD1 4.37Å; R154-I414 PolarHBondContact NH1-O 3.43Å; W171-I414 HydrophobicContact CH2-CD1 4.3Å; W171-I414 HydrophobicContact CZ2-CB 4.21Å; W171-I414 HydrophobicContact CZ2-CD1 3.95Å; W171-I414 HydrophobicContact CZ2-CG2 3.85Å; L385-I414 HydrophobicContact CD2-CD1 3.76Å; T396-I414 HydrophobicContact CG2-CD1 4.05Å; T396-I414 HydrophobicContact CG2-CG1 4Å; T396-I414 WeakPolarHBondContact O-CG1 3.21Å; T396-I414 PolarHBondContact O-N 3.27Å; I398-I414 HydrophobicContact CB-CG2 3.9Å; I398-I414 HydrophobicContact CG2-CG2 3.46Å; I398-I414 VanDerWaalsContact CG2-CG2 3.46Å; I414-Y419 HydrophobicContact CD1-CD2 3.84Å; I414-Y419 HydrophobicContact CD1-CE2 4.39Å; I414-Y419 HydrophobicContact CD1-CG 4.45Å; I414-Y419 HydrophobicContact CG1-CD2 4.07Å; I414-Y419 HydrophobicContact CG1-CE2 4.4Å
415	G	96.5	Very high	97.7	Very high	15 Å²	15	37.3 Å²	37.3	16%	0.155	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.7	168.4	173	0	0	0	0	0	114.4	A395 T396 V417	A395-G415 CarbonylContact C-O 3.51Å; A395-G415 VanDerWaalsContact CA-O 3.3Å; A395-G415 WeakPolarHBondContact CA-O 3.48Å; T396-G415 PolarHBondContact N-O 3.33Å; G415-V417 VanDerWaalsContact C-N 3.32Å
416	D	97	Very high	98	Very high	121 Å²	121	38.3 Å²	38.3	65%	0.647	20%	0.201	S	C	*	.	S	Bend	trans	-93.6	21.3	178.7	55.7	-19.1	0	0	0	113.1
417	V	97.3	Very high	98.1	Very high	23 Å²	23	33.2 Å²	33.2	14%	0.139	19%	0.185	C	C	.	.	S	Bend	trans	-134.5	161.2	177.5	-62.9	0	0	0	0	109	A135 L137 T396 G415 Y419	A135-V417 HydrophobicContact CB-CG2 4.36Å; L137-V417 HydrophobicContact CD2-CB 3.93Å; L137-V417 HydrophobicContact CD2-CG1 3.76Å; T396-V417 WeakPolarHBondContact CB-O 3.49Å; T396-V417 PolarHBondContact OG1-O 2.95Å; G415-V417 VanDerWaalsContact C-N 3.32Å; V417-Y419 HydrophobicContact CG2-CD2 4.2Å; V417-Y419 HydrophobicContact CG2-CE1 4.34Å; V417-Y419 HydrophobicContact CG2-CE2 3.75Å; V417-Y419 PolarHBondContact O-N 3.44Å
418	K	98.3	Very high	98.1	Very high	9 Å²	9	31.8 Å²	31.8	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	114.6	172.8	-54.5	-174.4	-53	172.6	0	108.5	A135 D136 D138 E389 I394 T396 E420	A135-K418 CarbonylContact C-O 3.52Å; A135-K418 WeakPolarHBondContact CA-O 3.47Å; D136-K418 PolarHBondContact N-O 3.48Å; D136-K418 VanDerWaalsContact O-O 3.08Å; D136-K418 WeakPolarHBondContact OD2-CE 3.38Å; D136-K418 IonicContact OD2-NZ 2.84Å; D136-K418 PolarHBondContact OD2-NZ 3.2Å; D138-K418 VanDerWaalsContact CG-NZ 3.27Å; D138-K418 IonicContact OD1-NZ 3.62Å; D138-K418 PolarHBondContact OD1-NZ 3.42Å; D138-K418 WeakPolarHBondContact OD2-CE 3.46Å; D138-K418 IonicContact OD2-NZ 2.69Å; D138-K418 PolarHBondContact OD2-NZ 2.95Å; D138-K418 VanDerWaalsContact OD2-NZ 3.13Å; E389-K418 HydrophobicContact CG-CD 4.06Å; E389-K418 IonicContact OE2-NZ 3.19Å; I394-K418 HydrophobicContact CG2-CG 3.66Å; T396-K418 VanDerWaalsContact OG1-CA 3.3Å; T396-K418 WeakPolarHBondContact OG1-CA 3.27Å; K418-E420 HydrophobicContact CB-CG 3.96Å; K418-E420 VanDerWaalsContact CD-OE1 3.26Å; K418-E420 WeakPolarHBondContact CD-OE1 3.49Å; K418-E420 WeakPolarHBondContact CE-OE1 3.42Å; K418-E420 IonicContact NZ-OE1 2.71Å; K418-E420 PolarHBondContact NZ-OE1 3.12Å; K418-E420 VanDerWaalsContact NZ-OE1 3.07Å
419	Y	98.8	Very high	98.1	Very high	1 Å²	1	32.9 Å²	32.9	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117.7	159.1	-60.3	-83.5	0	0	0	107.9	V133 I134 A135 R154 S369 L385 T396 I414 V417	V133-Y419 HydrophobicContact CB-CD1 4.01Å; V133-Y419 HydrophobicContact CB-CG 4.16Å; V133-Y419 HydrophobicContact CG2-CD1 3.58Å; V133-Y419 HydrophobicContact CG2-CD2 4.34Å; V133-Y419 HydrophobicContact CG2-CE1 3.87Å; V133-Y419 HydrophobicContact CG2-CG 3.85Å; I134-Y419 CarbonylContact O-C 3.45Å; I134-Y419 VanDerWaalsContact O-CA 3.26Å; I134-Y419 WeakPolarHBondContact O-CA 3.49Å; A135-Y419 HydrophobicContact CB-CD1 3.87Å; A135-Y419 HydrophobicContact CB-CE1 3.97Å; R154-Y419 HydrophobicContact CB-CE1 4.01Å; S369-Y419 PolarHBondContact OG-O 3.08Å; L385-Y419 WeakPolarHBondContact CD1-O 3.02Å; T396-Y419 HydrophobicContact CG2-CD2 4.28Å; T396-Y419 PolarHBondContact OG1-N 3.4Å; I414-Y419 HydrophobicContact CD1-CD2 3.84Å; I414-Y419 HydrophobicContact CD1-CE2 4.39Å; I414-Y419 HydrophobicContact CD1-CG 4.45Å; I414-Y419 HydrophobicContact CG1-CD2 4.07Å; I414-Y419 HydrophobicContact CG1-CE2 4.4Å; V417-Y419 HydrophobicContact CG2-CD2 4.2Å; V417-Y419 HydrophobicContact CG2-CE1 4.34Å; V417-Y419 HydrophobicContact CG2-CE2 3.75Å; V417-Y419 PolarHBondContact O-N 3.44Å
420	E	98.8	Very high	98.1	Very high	6 Å²	6	33.7 Å²	33.7	3%	0.028	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-4	-172.2	-62.7	-170.7	171	0	0	112	I134 D136 S192 D193 S370 K418	I134-E420 PolarHBondContact O-N 2.66Å; D136-E420 HydrophobicContact CB-CG 4.11Å; D136-E420 WeakPolarHBondContact CB-OE2 3.41Å; S192-E420 CarbonylContact C-O 3.58Å; S192-E420 PolarHBondContact OG-OE2 3.3Å; D193-E420 WeakPolarHBondContact CA-O 3.39Å; S370-E420 WeakPolarHBondContact CB-O 3.46Å; K418-E420 HydrophobicContact CB-CG 3.96Å; K418-E420 VanDerWaalsContact CD-OE1 3.26Å; K418-E420 WeakPolarHBondContact CD-OE1 3.49Å; K418-E420 WeakPolarHBondContact CE-OE1 3.42Å; K418-E420 IonicContact NZ-OE1 2.71Å; K418-E420 PolarHBondContact NZ-OE1 3.12Å; K418-E420 VanDerWaalsContact NZ-OE1 3.07Å
421	G	98.8	Very high	98.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.9	166.4	0	0	0	0	0	113.1	V133 I134 D193	V133-G421 CarbonylContact C-O 3.58Å; V133-G421 WeakPolarHBondContact CA-O 3.24Å; V133-G421 WeakPolarHBondContact CB-O 3.34Å; I134-G421 PolarHBondContact N-O 2.91Å; I134-G421 PolarHBondContact O-N 2.95Å; D193-G421 WeakPolarHBondContact OD1-CA 3.43Å
422	L	98.8	Very high	98.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.5	176.3	169.3	66.4	0	0	0	109.6	G132 V133 S370 K372 L383 L385	G132-L422 WeakPolarHBondContact O-CA 3.49Å; V133-L422 HydrophobicContact CG1-CB 4.32Å; V133-L422 HydrophobicContact CG1-CD1 3.6Å; S370-L422 PolarHBondContact OG-N 2.91Å; K372-L422 VanDerWaalsContact CE-O 3.28Å; K372-L422 WeakPolarHBondContact CE-O 3.34Å; K372-L422 WeakPolarHBondContact CG-O 3.43Å; K372-L422 PolarHBondContact NZ-O 3.19Å; L383-L422 HydrophobicContact CB-CD2 4.18Å; L383-L422 HydrophobicContact CD2-CD1 3.77Å; L383-L422 HydrophobicContact CD2-CD2 3.74Å; L383-L422 HydrophobicContact CD2-CG 4.21Å; L383-L422 HydrophobicContact CG-CD2 3.7Å; L383-L422 WeakPolarHBondContact O-CD2 3.26Å; L385-L422 HydrophobicContact CD1-CB 3.85Å; L385-L422 HydrophobicContact CG-CB 3.93Å; L385-L422 HydrophobicContact CG-CD2 4.18Å
423	E	98.9	Very high	98.2	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.019	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.9	176.2	-171.4	55	-73.1	0	0	113.7	Y115 I131 G132 L194 V195 V196 L201 K372 I425	Y115-E423 WeakPolarHBondContact CE2-OE1 3.28Å; Y115-E423 PolarHBondContact OH-OE1 3.32Å; I131-E423 CarbonylContact C-O 3.36Å; I131-E423 WeakPolarHBondContact CA-O 3.39Å; G132-E423 PolarHBondContact N-O 2.95Å; G132-E423 PolarHBondContact O-N 3.48Å; L194-E423 HydrophobicContact CB-CB 4.23Å; L194-E423 HydrophobicContact CD2-CB 3.82Å; L194-E423 HydrophobicContact CG-CB 3.82Å; V195-E423 VanDerWaalsContact CA-OE2 3.29Å; V195-E423 WeakPolarHBondContact CA-OE2 3.11Å; V196-E423 HydrophobicContact CB-CG 4.24Å; V196-E423 HydrophobicContact CG2-CG 3.66Å; V196-E423 PolarHBondContact N-OE2 3.32Å; L201-E423 HydrophobicContact CD1-CB 4.46Å; L201-E423 HydrophobicContact CD1-CG 4.24Å; K372-E423 WeakPolarHBondContact CE-OE2 3.2Å; E423-I425 HydrophobicContact CB-CG2 4.29Å; E423-I425 HydrophobicContact CG-CG2 4.41Å
424	F	98.9	Very high	98.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	111.7	166.4	-64.6	-83.8	0	0	0	110	Y115 P116 Y129 R130 I131 L158 K372 F373 I374 P375 L383	Y115-F424 HydrophobicContact CE2-CB 4.49Å; P116-F424 HydrophobicContact CB-CB 3.89Å; P116-F424 HydrophobicContact CG-CB 3.74Å; Y129-F424 HydrophobicContact CD1-CD1 4.42Å; Y129-F424 HydrophobicContact CG-CD1 4.17Å; Y129-F424 HydrophobicContact CG-CE1 4.23Å; R130-F424 WeakPolarHBondContact O-CA 3.34Å; I131-F424 HydrophobicContact CG2-CD1 3.61Å; I131-F424 HydrophobicContact CG2-CE1 3.68Å; I131-F424 HydrophobicContact CG2-CG 4.42Å; L158-F424 HydrophobicContact CB-CE1 4.44Å; L158-F424 HydrophobicContact CD1-CE1 4.32Å; L158-F424 HydrophobicContact CD1-CZ 4.34Å; K372-F424 HydrophobicContact CB-CD2 4.1Å; K372-F424 HydrophobicContact CB-CE2 3.9Å; F373-F424 VanDerWaalsContact O-CE2 3.26Å; F373-F424 WeakPolarHBondContact O-CE2 3.35Å; I374-F424 HydrophobicContact CB-CZ 4.21Å; I374-F424 HydrophobicContact CG1-CZ 4.07Å; I374-F424 HydrophobicContact CG2-CE1 4.4Å; I374-F424 HydrophobicContact CG2-CZ 4.11Å; P375-F424 HydrophobicContact CG-CB 4.41Å; P375-F424 HydrophobicContact CG-CD1 4.32Å; P375-F424 HydrophobicContact CG-CD2 4.13Å; P375-F424 HydrophobicContact CG-CG 4.02Å; L383-F424 HydrophobicContact CB-CZ 4.46Å; L383-F424 HydrophobicContact CD2-CZ 4.13Å
425	I	97.9	Very high	98.2	Very high	21 Å²	21	18.2 Å²	18.2	11%	0.108	10%	0.104	C	C	.	.			trans	-109.6	0	-170	68.9	174.6	0	0	0	112.3	T118 R130 M153 R155 L201 E423	T118-I425 WeakPolarHBondContact CA-O 3.42Å; T118-I425 WeakPolarHBondContact CB-O 3.26Å; T118-I425 WeakPolarHBondContact CB-OXT 3.44Å; T118-I425 VanDerWaalsContact N-C 3.33Å; T118-I425 PolarHBondContact N-O 2.96Å; T118-I425 PolarHBondContact N-OXT 3.05Å; T118-I425 PolarHBondContact OG1-O 2.7Å; T118-I425 PolarHBondContact OG1-OXT 3.15Å; R130-I425 HydrophobicContact CB-CG1 4.11Å; R130-I425 HydrophobicContact CG-CD1 4.09Å; R130-I425 HydrophobicContact CG-CG1 3.57Å; R130-I425 PolarHBondContact O-N 3.25Å; M153-I425 HydrophobicContact CE-CD1 3.56Å; M153-I425 HydrophobicContact CE-CG2 4.18Å; R155-I425 HydrophobicContact CG-CD1 3.92Å; L201-I425 HydrophobicContact CD1-CG2 3.71Å; L201-I425 HydrophobicContact CD2-CG2 4.02Å; E423-I425 HydrophobicContact CB-CG2 4.29Å; E423-I425 HydrophobicContact CG-CG2 4.41Å

Retrieved 425 of 425 residues in 607.3 ms (Link to these results)

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