A0A024FLK4_ORYSJ Loading...

Argininosuccinate lyase

AlphaFold DB , UniProt , Accession A0A024FLK4, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene OsASL1, Length 751 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.1	Very low	38.7	Very low	240 Å²	240	151.6 Å²	151.6	100%	1.182	86%	0.864	S	S	*	*				0	154.7	0	-73.7	170.3	165.1	0	0	108.3
2	S	40.1	Very low	38.4	Very low	107 Å²	107	148.2 Å²	148.2	75%	0.748	86%	0.856	S	S	*	*			trans	53.3	93.2	178.7	-55.8	0	0	0	0	116.6
3	T	38.3	Very low	38	Very low	122 Å²	122	150.4 Å²	150.4	75%	0.748	85%	0.854	S	S	*	*				63.6	92	85.5	63.6	0	0	0	0	113
4	V	37.3	Very low	37.5	Very low	140 Å²	140	156.4 Å²	156.4	85%	0.848	86%	0.856	S	S	*	*				66.5	106.6	72.8	-179.5	0	0	0	0	113.3
5	A	46.2	Very low	37.1	Very low	97 Å²	97	161.8 Å²	161.8	80%	0.802	86%	0.859	S	S	*	*			trans	-150.9	125.5	154.2	0	0	0	0	0	109.4
6	T	39.3	Very low	37	Very low	135 Å²	135	161.6 Å²	161.6	83%	0.828	87%	0.866	S	S	*	*			trans	-134.7	136	170	48.3	0	0	0	0	110.3
7	P	47	Very low	36.7	Very low	124 Å²	124	165.8 Å²	165.8	81%	0.805	87%	0.866	S	S	*	*			trans	-116.5	109.3	163.9	32.2	-19.7	0	0	0	112.2	G9	P7-G9 PolarHBondContact O-N 2.68Å
8	R	35.1	Very low	36.5	Very low	249 Å²	249	163.3 Å²	163.3	94%	0.94	86%	0.864	S	S	*	*			trans	-4.9	108	152.3	-62.5	169.2	177.3	169.6	-2.3	117.3
9	G	30.4	Very low	36.4	Very low	77 Å²	77	165.1 Å²	165.1	79%	0.794	86%	0.864	S	S	*	*				52.4	121.9	117.7	0	0	0	0	0	121.4	P7	P7-G9 PolarHBondContact O-N 2.68Å
10	R	34.4	Very low	36.4	Very low	258 Å²	258	163.1 Å²	163.1	97%	0.974	86%	0.862	S	S	*	*			trans	-141.5	147	145.4	-110.8	-178.4	-178.9	-170.6	0.7	110.4
11	S	35.1	Very low	36.4	Very low	119 Å²	119	160.4 Å²	160.4	83%	0.832	86%	0.864	S	S	*	*			trans	-112.6	131.5	-179.1	48.5	0	0	0	0	111.8
12	S	35.4	Very low	36	Very low	110 Å²	110	152.9 Å²	152.9	77%	0.769	85%	0.847	S	S	*	*			trans	-148.2	113.1	162	44.6	0	0	0	0	107.3
13	Q	33.5	Very low	35.8	Very low	177 Å²	177	151.9 Å²	151.9	83%	0.827	85%	0.854	S	S	*	*				56.4	94.6	82.7	-64.3	-165.3	7.8	0	0	111.3
14	R	30.7	Very low	35.5	Very low	235 Å²	235	150.1 Å²	150.1	89%	0.887	86%	0.86	S	S	*	*				77.1	116.4	88.5	-86.4	-170.9	170.7	-162.7	-0.6	113.5
15	R	31.1	Very low	35.2	Very low	237 Å²	237	147.5 Å²	147.5	89%	0.894	86%	0.861	S	S	*	*			trans	38.7	105	152.1	-67.6	-175.5	175	-177.4	-2.8	116.6	R17	R15-R17 PolarHBondContact O-N 3.44Å
16	T	35.3	Very low	34.6	Very low	159 Å²	159	146.6 Å²	146.6	98%	0.975	86%	0.861	S	S	*	*			trans	-56.5	94	160.4	32.4	0	0	0	0	111.4
17	R	32.2	Very low	34.4	Very low	232 Å²	232	146.3 Å²	146.3	88%	0.875	86%	0.855	S	S	*	*			trans	-103.1	124.7	171.9	-145.5	-179.6	-168.1	-172.6	2.1	107.8	R15	R15-R17 PolarHBondContact O-N 3.44Å
18	C	34.3	Very low	34	Very low	122 Å²	122	150.9 Å²	150.9	82%	0.824	86%	0.856	S	S	*	*			trans	-62.5	142.9	179.9	-166.8	0	0	0	0	111.1
19	K	34.1	Very low	34	Very low	197 Å²	197	144.4 Å²	144.4	86%	0.857	86%	0.856	S	S	*	*			trans	-94.6	108.9	-176.3	-71.2	-177.8	178.4	178.9	0	111.5
20	C	36.5	Very low	34.2	Very low	124 Å²	124	145.7 Å²	145.7	84%	0.838	86%	0.859	S	S	*	*			trans	-134.8	97.7	163	-59.1	0	0	0	0	108.6
21	A	35.3	Very low	34.5	Very low	108 Å²	108	137.9 Å²	137.9	89%	0.893	85%	0.85	S	S	*	*			trans	-161.2	131.4	175.5	0	0	0	0	0	110.9
22	G	34.9	Very low	34.6	Very low	81 Å²	81	138.7 Å²	138.7	84%	0.835	85%	0.854	S	S	*	*			trans	136.6	124.2	174.3	0	0	0	0	0	112.9
23	G	34.9	Very low	34.5	Very low	87 Å²	87	138.9 Å²	138.9	90%	0.897	85%	0.854	S	S	*	*			trans	94.3	135.2	-173.8	0	0	0	0	0	112.2
24	G	31.7	Very low	34.5	Very low	84 Å²	84	140.4 Å²	140.4	87%	0.866	86%	0.858	S	S	*	*			trans	-147.5	171.1	-175.6	0	0	0	0	0	113.5
25	G	32.4	Very low	34.9	Very low	85 Å²	85	135.5 Å²	135.5	88%	0.876	85%	0.85	S	S	*	*			trans	100.4	133	-178.9	0	0	0	0	0	113.3
26	G	32.7	Very low	35	Very low	78 Å²	78	129.9 Å²	129.9	80%	0.804	84%	0.844	S	S	*	*			trans	94.8	98	168.3	0	0	0	0	0	116.6
27	D	35.2	Very low	35.1	Very low	129 Å²	129	128.9 Å²	128.9	69%	0.69	83%	0.832	S	S	*	*			trans	38.2	131.7	138.6	-96.4	32.4	0	0	0	123.1
28	R	37.9	Very low	35.2	Very low	220 Å²	220	129.7 Å²	129.7	83%	0.83	84%	0.835	S	S	*	*			trans	73.3	86.1	147.3	-59.8	169.5	-164.8	-142.3	-2.3	118.7
29	A	35.7	Very low	35.1	Very low	113 Å²	113	129.6 Å²	129.6	93%	0.934	84%	0.835	S	S	*	*			trans	34.7	93.7	131.8	0	0	0	0	0	118.5
30	A	34.3	Very low	35	Very low	104 Å²	104	128 Å²	128	86%	0.86	84%	0.835	S	S	*	*			trans	-114.3	127.1	159.8	0	0	0	0	0	109.9
31	A	42.2	Very low	35	Very low	95 Å²	95	132.4 Å²	132.4	79%	0.785	84%	0.841	S	S	*	*			trans	-96.8	147.2	174.9	0	0	0	0	0	110.7
32	C	35.6	Very low	35	Very low	135 Å²	135	139.3 Å²	139.3	91%	0.912	84%	0.844	S	S	*	*			trans	-73.5	134.3	-175.6	-167.6	0	0	0	0	112
33	C	34.2	Very low	34.9	Very low	115 Å²	115	141.2 Å²	141.2	78%	0.777	84%	0.843	S	S	*	*			trans	-92.1	108.2	-176.1	-61.3	0	0	0	0	112.3
34	F	34.3	Very low	35.1	Very low	209 Å²	209	142.5 Å²	142.5	92%	0.917	84%	0.836	S	S	*	*			trans	-158.1	91.1	153	-125.5	-80	0	0	0	111.1
35	N	37.4	Very low	35.6	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	83%	0.833	S	S	*	*			trans	-158.9	109	169	-173.4	-10.6	0	0	0	110.3	L37	N35-L37 PolarHBondContact O-N 3.08Å; N35-L37 PolarHBondContact OD1-N 3.39Å
36	P	33.8	Very low	35.9	Very low	119 Å²	119	150.1 Å²	150.1	77%	0.773	84%	0.836	S	S	*	*			trans	-91.4	28.9	-171.1	37	-36.5	0	0	0	115
37	L	36.8	Very low	35.9	Very low	137 Å²	137	150 Å²	150	72%	0.717	84%	0.836	S	S	*	*			trans	-135.6	88.8	-176.9	-69.5	175.7	0	0	0	114	N35	N35-L37 PolarHBondContact O-N 3.08Å; N35-L37 PolarHBondContact OD1-N 3.39Å
38	R	34.3	Very low	36.2	Very low	249 Å²	249	156 Å²	156	94%	0.94	85%	0.849	S	S	*	*			trans	167	110.9	151.3	-96.6	155.7	-177.3	-110.2	0.2	113
39	S	32.2	Very low	36.1	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	85%	0.846	S	S	*	*			trans	-165.9	8.7	161.2	54	0	0	0	0	118.4
40	L	33.2	Very low	36.1	Very low	163 Å²	163	155 Å²	155	85%	0.853	84%	0.844	S	S	*	*			trans	-124.1	72.7	-179.1	-73.8	178.3	0	0	0	114.7
41	F	36.1	Very low	36.3	Very low	217 Å²	217	161.3 Å²	161.3	95%	0.952	85%	0.846	S	S	*	*			trans	-158.1	116.1	150.5	-97.3	-66.3	0	0	0	110.3
42	R	35.5	Very low	36	Very low	253 Å²	253	161.2 Å²	161.2	96%	0.955	84%	0.839	S	S	*	*			trans	-105.2	98.2	-179.5	-152.9	-178	-162.8	-162.9	6.6	109.6
43	C	32.8	Very low	36.1	Very low	121 Å²	121	166 Å²	166	82%	0.818	84%	0.838	S	S	*	*			trans	-74	129	-175.9	-168.8	0	0	0	0	111.8	G45	C43-G45 PolarHBondContact O-N 3.12Å
44	P	39.8	Very low	36.3	Very low	115 Å²	115	164.9 Å²	164.9	75%	0.747	83%	0.831	S	S	*	*			trans	-76.3	114.3	-179.1	29.2	-33.6	0	0	0	112	R46	P44-R46 PolarHBondContact O-N 2.69Å
45	G	41.3	Very low	36.5	Very low	79 Å²	79	166.5 Å²	166.5	81%	0.814	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-65.9	124.2	178.4	0	0	0	0	0	112.8	C43 G47	C43-G45 PolarHBondContact O-N 3.12Å; G45-G47 PolarHBondContact O-N 2.63Å
46	R	39.9	Very low	36.5	Very low	249 Å²	249	165.2 Å²	165.2	94%	0.94	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-65.4	126.5	178.8	-73.5	-178	170.4	-168.2	-4	112.1	P44	P44-R46 PolarHBondContact O-N 2.69Å
47	G	32.1	Very low	36.7	Very low	77 Å²	77	169.6 Å²	169.6	79%	0.794	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-70.6	136.7	167.1	0	0	0	0	0	112.8	G45	G45-G47 PolarHBondContact O-N 2.63Å
48	R	41.2	Very low	36.8	Very low	254 Å²	254	170.6 Å²	170.6	96%	0.958	83%	0.834	S	S	*	*			trans	-136.2	110.2	157.1	-84.9	-170	168.6	-166.1	-2.1	108.1
49	G	34.7	Very low	37	Very low	75 Å²	75	164.8 Å²	164.8	77%	0.773	83%	0.826	S	S	*	*			trans	-104.6	155.9	178.9	0	0	0	0	0	113.1
50	R	37.3	Very low	37.2	Very low	237 Å²	237	165.3 Å²	165.3	89%	0.894	83%	0.825	S	S	*	*			trans	-163.1	128	147.5	-108.5	171.4	-173.2	-157	1.5	110.2
51	R	36.8	Very low	37.6	Very low	237 Å²	237	163.3 Å²	163.3	89%	0.894	82%	0.822	S	S	*	*			trans	31.8	134.4	132.7	-66.4	-178.6	-177.8	-171.1	-0.2	117.8
52	S	36.9	Very low	37.8	Very low	92 Å²	92	159 Å²	159	64%	0.643	82%	0.819	S	S	*	*			cis	-174.8	159.8	16.7	53.8	0	0	0	0	114.8
53	R	38	Very low	37.9	Very low	237 Å²	237	156.4 Å²	156.4	89%	0.894	81%	0.814	S	S	*	*			trans	66.8	150.4	150.3	-73.6	167.1	179	-176.9	-1	117
54	S	37.4	Very low	38.3	Very low	90 Å²	90	157.4 Å²	157.4	63%	0.629	82%	0.816	S	S	*	*			cis	-174	147.3	-16	50.6	0	0	0	0	112.5
55	R	39	Very low	38.3	Very low	243 Å²	243	163 Å²	163	92%	0.917	82%	0.822	S	S	*	*			trans	66.7	151.6	162.7	-66.5	173.2	177.7	-179	-2.1	115.7
56	S	37.4	Very low	37.9	Very low	105 Å²	105	167.2 Å²	167.2	73%	0.734	83%	0.827	S	S	*	*			cis	-161.5	159.8	-10.1	38.9	0	0	0	0	111.8
57	R	37.2	Very low	37.8	Very low	212 Å²	212	160.6 Å²	160.6	80%	0.8	83%	0.825	S	S	*	*			trans	0.4	135.2	158.2	-47.6	173.7	173.9	172.3	-4.7	116.8
58	H	39.9	Very low	37.8	Very low	157 Å²	157	162.3 Å²	162.3	73%	0.727	82%	0.824	S	S	*	*				-164.3	174.3	54.8	-79.9	-92.9	0	0	0	109
59	T	37.5	Very low	37.7	Very low	127 Å²	127	156.6 Å²	156.6	78%	0.779	82%	0.818	S	S	*	*			cis	-151.1	-154.7	7.2	-12.7	0	0	0	0	112.7
60	T	38	Very low	37.8	Very low	131 Å²	131	157.9 Å²	157.9	80%	0.804	82%	0.821	S	S	*	*			trans	-91.3	175.4	-172.9	30.7	0	0	0	0	117.1
61	P	41.5	Very low	37.6	Very low	121 Å²	121	150.6 Å²	150.6	79%	0.786	82%	0.82	S	S	*	*			trans	-122.7	-173.8	-151.3	45.8	-35.4	0	0	0	117.3
62	S	39.6	Very low	37.4	Very low	127 Å²	127	143.2 Å²	143.2	89%	0.888	82%	0.817	S	S	*	*			trans	-117.6	155.5	175	-65	0	0	0	0	113.7
63	K	38.5	Very low	37.2	Very low	199 Å²	199	145 Å²	145	87%	0.865	82%	0.824	S	S	*	*			trans	-117.5	150.2	-177.3	-60.3	178.8	178.4	-178.3	0	113.4
64	V	40.3	Very low	36.9	Very low	142 Å²	142	141.5 Å²	141.5	86%	0.861	82%	0.818	S	S	*	*			trans	-144	107.8	149.4	-175.4	0	0	0	0	105.1
65	R	39.7	Very low	36.7	Very low	231 Å²	231	146.8 Å²	146.8	87%	0.872	83%	0.833	S	S	*	*				85.1	106.8	62.3	-89.5	-167.3	171	178.8	-1.7	113.9
66	D	32.2	Very low	36.2	Very low	169 Å²	169	143.9 Å²	143.9	90%	0.904	83%	0.829	S	S	*	*			trans	-79.1	157.4	165.3	-46.1	-89.7	0	0	0	112.7
67	A	38.8	Very low	36	Very low	109 Å²	109	144 Å²	144	90%	0.901	83%	0.83	S	S	*	*			trans	-156.2	149.7	154.9	0	0	0	0	0	109.4
68	S	33	Very low	35.8	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	83%	0.827	S	S	*	*			trans	-115.3	166.1	-173.8	55.1	0	0	0	0	112.6
69	V	37.4	Very low	35.3	Very low	135 Å²	135	141.9 Å²	141.9	82%	0.818	83%	0.83	S	S	*	*				174.7	132.5	127.3	149.8	0	0	0	0	112.6
70	A	37.2	Very low	35	Very low	101 Å²	101	141.3 Å²	141.3	84%	0.835	83%	0.828	S	S	*	*			trans	27.9	137.3	155.4	0	0	0	0	0	124.4
71	G	32.4	Very low	34.6	Very low	85 Å²	85	139.7 Å²	139.7	88%	0.876	82%	0.822	S	S	*	*			trans	122.2	103.4	132.3	0	0	0	0	0	117.6
72	G	33.1	Very low	34.1	Very low	81 Å²	81	142.9 Å²	142.9	84%	0.835	82%	0.824	S	S	*	*			trans	171	117.2	170.2	0	0	0	0	0	112.5
73	V	34	Very low	33.8	Very low	130 Å²	130	145.7 Å²	145.7	79%	0.788	82%	0.821	S	S	*	*			trans	-99.9	139.3	-168.2	166.9	0	0	0	0	112.3
74	E	30.6	Very low	33.5	Very low	164 Å²	164	139.7 Å²	139.7	77%	0.766	80%	0.801	S	S	*	*			trans	34.1	124.2	157.9	-63.7	167.3	154.8	0	0	121.2
75	Q	33.7	Very low	33.3	Very low	201 Å²	201	140 Å²	140	94%	0.939	79%	0.787	S	S	*	*				-147.6	131.7	109.9	-116.5	175.8	3	0	0	110.7
76	Q	29.1	Very low	32.8	Very low	182 Å²	182	133.4 Å²	133.4	85%	0.85	78%	0.783	S	S	*	*			trans	-95.9	139.3	178.7	-71.6	178	-30.2	0	0	111.2
77	S	33	Very low	32.9	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	77%	0.768	S	S	*	*			trans	-132.7	108.8	161.4	55.4	0	0	0	0	108.5	E79	S77-E79 PolarHBondContact O-N 3.42Å; S77-E79 VanDerWaalsContact O-N 3.12Å
78	E	31.8	Very low	32.7	Very low	155 Å²	155	131.2 Å²	131.2	72%	0.724	76%	0.759	S	S	*	*			trans	-70.5	101.5	173.9	-71.2	-161	167.6	0	0	110	R673	E78-R673 IonicContact OE2-NH1 2.67Å; E78-R673 IonicContact OE2-NH2 3.12Å; E78-R673 PolarHBondContact OE2-NH2 3.37Å
79	E	30.7	Very low	32.6	Very low	169 Å²	169	133.2 Å²	133.2	79%	0.79	76%	0.761	S	S	*	*			trans	-83.4	135.8	157.9	-69.5	-166.9	145.3	0	0	109.8	S77 S81	S77-E79 PolarHBondContact O-N 3.42Å; S77-E79 VanDerWaalsContact O-N 3.12Å; E79-S81 PolarHBondContact O-N 3.02Å; E79-S81 VanDerWaalsContact O-N 3.15Å
80	P	31.1	Very low	32.4	Very low	115 Å²	115	136.2 Å²	136.2	75%	0.747	77%	0.766	S	S	*	*			trans	-71.7	109.5	177.8	28.8	-33.3	0	0	0	110.4	F82	P80-F82 PolarHBondContact O-N 3.05Å
81	S	29.6	Very low	32	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	76%	0.759	S	S	*	*			trans	-73.2	83.3	-174.4	48.5	0	0	0	0	113.2	E79 F83	E79-S81 PolarHBondContact O-N 3.02Å; E79-S81 VanDerWaalsContact O-N 3.15Å; S81-F83 VanDerWaalsContact C-N 3.29Å; S81-F83 PolarHBondContact O-N 3.39Å
82	F	30.4	Very low	31.9	Very low	187 Å²	187	134.5 Å²	134.5	82%	0.82	76%	0.758	S	S	*	*			trans	-65.9	82.7	169.1	-105.7	-92.1	0	0	0	111.3	P80 V84	P80-F82 PolarHBondContact O-N 3.05Å; F82-V84 PolarHBondContact O-N 3.21Å
83	F	33.5	Very low	31.7	Very low	186 Å²	186	134.3 Å²	134.3	82%	0.816	76%	0.757	S	S	*	*			trans	-82.6	109.6	175.1	-101.1	-84.5	0	0	0	111.7	S81	S81-F83 VanDerWaalsContact C-N 3.29Å; S81-F83 PolarHBondContact O-N 3.39Å
84	V	33.1	Very low	31.8	Very low	74 Å²	74	136.5 Å²	136.5	45%	0.448	76%	0.764	S	S	.	*			trans	-72.9	128.7	168.5	178.4	0	0	0	0	109.4	F82 A86 Q449	F82-V84 PolarHBondContact O-N 3.21Å; V84-A86 PolarHBondContact O-N 3.48Å; V84-Q449 HydrophobicContact CG1-CG 3.72Å
85	Y	35	Very low	31.7	Very low	147 Å²	147	132.2 Å²	132.2	58%	0.576	76%	0.763	S	S	*	*			trans	-67.6	102.4	172.4	-88.2	-90.2	0	0	0	110.8	M87	Y85-M87 PolarHBondContact O-N 2.9Å
86	A	29.7	Very low	31.8	Very low	94 Å²	94	129.7 Å²	129.7	78%	0.777	76%	0.762	S	S	*	*			trans	-82	103.2	172.5	0	0	0	0	0	110.8	V84	V84-A86 PolarHBondContact O-N 3.48Å
87	M	34.2	Very low	31.9	Very low	122 Å²	122	127.1 Å²	127.1	60%	0.601	76%	0.758	S	S	*	*			trans	-71.8	139.6	172.2	-78	-70.8	-178.1	0	0	111.6	Y85	Y85-M87 PolarHBondContact O-N 2.9Å
88	P	33.8	Very low	32	Very low	109 Å²	109	126.8 Å²	126.8	71%	0.708	76%	0.762	S	S	*	*			trans	-71.4	132.8	175.8	29.3	-33.8	0	0	0	111.4	Q90	P88-Q90 PolarHBondContact O-N 3Å; P88-Q90 VanDerWaalsContact O-N 3.14Å
89	N	31.3	Very low	32.2	Very low	156 Å²	156	126.2 Å²	126.2	83%	0.834	76%	0.764	S	S	*	*			trans	-72	102.1	-176.3	-175.9	9.9	0	0	0	112.1	G91	N89-G91 VanDerWaalsContact C-N 3.27Å; N89-G91 PolarHBondContact O-N 2.93Å
90	Q	33.5	Very low	32.5	Very low	197 Å²	197	126 Å²	126	92%	0.921	76%	0.763	S	S	*	*			trans	-78.6	73.8	171.3	-71.1	-156.8	18	0	0	111.9	P88	P88-Q90 PolarHBondContact O-N 3Å; P88-Q90 VanDerWaalsContact O-N 3.14Å
91	G	28.8	Very low	32.7	Very low	67 Å²	67	126.6 Å²	126.6	69%	0.691	77%	0.769	S	S	*	*			trans	-111.6	95	167.8	0	0	0	0	0	111.1	N89	N89-G91 VanDerWaalsContact C-N 3.27Å; N89-G91 PolarHBondContact O-N 2.93Å
92	G	31.2	Very low	33	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	78%	0.778	S	S	*	*			trans	-175.6	102.5	178.4	0	0	0	0	0	112.2
93	G	28.4	Very low	33.3	Very low	78 Å²	78	132.7 Å²	132.7	80%	0.804	78%	0.783	S	S	*	*			trans	-107.3	144.7	173.2	0	0	0	0	0	111.3
94	D	35.7	Very low	33.4	Very low	176 Å²	176	133.3 Å²	133.3	94%	0.941	79%	0.786	S	S	*	*			trans	-134.6	138.5	164.5	-108.1	-41.1	0	0	0	108.9
95	G	29.1	Very low	33.5	Very low	73 Å²	73	140 Å²	140	75%	0.753	81%	0.809	S	S	*	*			trans	-108	134.3	-175.4	0	0	0	0	0	112.3
96	V	35.2	Very low	33.5	Very low	149 Å²	149	142.2 Å²	142.2	90%	0.903	82%	0.821	S	S	*	*			trans	-124.5	136.4	172.8	-176.7	0	0	0	0	109.6
97	T	32.2	Very low	33.9	Very low	128 Å²	128	147.4 Å²	147.4	79%	0.785	83%	0.826	S	S	*	*			trans	-116.4	144.9	-168.2	53.9	0	0	0	0	113.5
98	A	33.9	Very low	33.9	Very low	100 Å²	100	149.2 Å²	149.2	83%	0.826	83%	0.831	S	S	*	*			trans	69.1	148.4	168.8	0	0	0	0	0	114.9
99	D	36.1	Very low	34	Very low	143 Å²	143	151.1 Å²	151.1	77%	0.765	83%	0.83	S	S	*	*			cis	-138.7	-175.3	40.4	-161.1	5.8	0	0	0	115.2
100	H	36.4	Very low	34.1	Very low	165 Å²	165	148.6 Å²	148.6	76%	0.764	82%	0.824	S	S	*	*			trans	-79.8	155.3	-164.7	-62.3	-63.1	0	0	0	117.1
101	S	35.2	Very low	34.2	Very low	127 Å²	127	149 Å²	149	89%	0.888	82%	0.823	S	S	*	*				-158.8	135.6	121.5	-95.3	0	0	0	0	117.5
102	K	36.8	Very low	34.5	Very low	196 Å²	196	151.2 Å²	151.2	85%	0.852	83%	0.826	S	S	*	*			trans	-61.8	146.6	-172.5	-56.6	137	-180	164.4	0	115.8
103	K	36.3	Very low	34.6	Very low	216 Å²	216	158.9 Å²	158.9	94%	0.939	83%	0.829	S	S	*	*				-161.8	167.1	116.7	-106.9	161.5	-172.6	173.6	0	113
104	K	35.3	Very low	34.8	Very low	199 Å²	199	163.2 Å²	163.2	87%	0.865	83%	0.832	S	S	*	*			trans	-117.7	152.8	-159.6	-53.9	168.6	-179.6	169.7	0	113.4
105	K	36.8	Very low	35	Very low	216 Å²	216	160.7 Å²	160.7	94%	0.939	83%	0.826	S	S	*	*				-161.6	166.1	123.6	-106.4	164.8	-175.6	179.9	0	111.3
106	K	34	Very low	35.1	Very low	192 Å²	192	162.7 Å²	162.7	84%	0.835	83%	0.828	S	S	*	*			trans	-134.1	149.6	-165.6	-70.8	-179.2	174.5	179.9	0	113.5
107	K	37.6	Very low	35.2	Very low	203 Å²	203	163.4 Å²	163.4	88%	0.883	83%	0.825	S	S	*	*			trans	-171.3	130.3	145.7	-98.9	168.5	-176.4	-174.1	0	105.1
108	K	35	Very low	35.1	Very low	161 Å²	161	168.3 Å²	168.3	70%	0.7	83%	0.829	S	S	*	*			cis	57	125.1	36.2	-73.2	-164.7	162.9	-136.3	0	112.2
109	H	35.2	Very low	35.1	Very low	149 Å²	149	169.3 Å²	169.3	69%	0.69	83%	0.83	S	S	*	*			cis	-162.8	172.8	4.3	-99	-44.9	0	0	0	108
110	S	34.5	Very low	34.9	Very low	102 Å²	102	168.4 Å²	168.4	71%	0.713	83%	0.834	S	S	*	*			cis	-169.5	166.6	-7.9	41.8	0	0	0	0	110.4
111	K	33.8	Very low	34.5	Very low	206 Å²	206	170.1 Å²	170.1	90%	0.896	84%	0.839	S	S	*	*			trans	-73	153.1	171.2	-71.6	-171.5	174.7	-173.1	0	112.7
112	P	36.2	Very low	34.5	Very low	114 Å²	114	176 Å²	176	74%	0.74	84%	0.842	S	S	*	*				-149.5	149.2	113.8	37.6	-21.5	0	0	0	117.9
113	R	32.9	Very low	34.2	Very low	244 Å²	244	170.3 Å²	170.3	92%	0.921	84%	0.839	S	S	*	*			trans	49.2	132.6	143.7	-61.6	-176	178.2	-159	-1.8	123.2
114	L	32.1	Very low	34.2	Very low	168 Å²	168	170.3 Å²	170.3	88%	0.88	84%	0.839	S	S	*	*			trans	-74.8	152.9	160	-76.7	156.1	0	0	0	113
115	P	40.3	Very low	34.2	Very low	124 Å²	124	170.1 Å²	170.1	81%	0.805	84%	0.838	S	S	*	*			trans	-103.1	167.7	152	37.7	-29.7	0	0	0	112.3
116	S	30.6	Very low	34	Very low	114 Å²	114	166.8 Å²	166.8	80%	0.797	83%	0.831	S	S	*	*			trans	-141.6	148.9	174.6	63.2	0	0	0	0	112.2
117	I	37.8	Very low	34.1	Very low	165 Å²	165	165.4 Å²	165.4	85%	0.846	83%	0.825	S	S	*	*			trans	-173.7	126.1	163.8	-92.8	140.2	0	0	0	104.5
118	R	31.5	Very low	34	Very low	231 Å²	231	162.8 Å²	162.8	87%	0.872	82%	0.816	S	S	*	*			cis	88.6	129	43	-93.2	-167.2	169.3	-170.5	-1.7	115.7
119	S	32.6	Very low	34	Very low	120 Å²	120	165.6 Å²	165.6	84%	0.839	82%	0.822	S	S	*	*			trans	74.3	150.4	170.8	83.7	0	0	0	0	116.2
120	C	32.6	Very low	34	Very low	125 Å²	125	167.6 Å²	167.6	85%	0.845	83%	0.829	S	S	*	*			cis	-150.9	161.5	0.4	-145.4	0	0	0	0	114
121	F	28.5	Very low	34.1	Very low	201 Å²	201	166.9 Å²	166.9	88%	0.882	83%	0.829	S	S	*	*			trans	-82.1	138.8	174.3	-93.7	-106.5	0	0	0	112.8
122	R	34.4	Very low	34.2	Very low	249 Å²	249	165.2 Å²	165.2	94%	0.94	83%	0.83	S	S	*	*				169.3	138.2	126.1	-97	172.4	164.6	-172.9	-5.5	111.8
123	G	30.7	Very low	34	Very low	77 Å²	77	164.6 Å²	164.6	79%	0.794	83%	0.834	S	S	*	*			trans	-103.5	-179.5	178.7	0	0	0	0	0	114.9
124	K	36.4	Very low	34.1	Very low	217 Å²	217	157.9 Å²	157.9	94%	0.943	83%	0.831	S	S	*	*			trans	-145.7	153.9	170.6	-99	179.6	176.3	177.6	0	111
125	K	35.3	Very low	34.1	Very low	194 Å²	194	154.1 Å²	154.1	84%	0.843	82%	0.824	S	S	*	*			trans	-93	159.3	177.1	-70.9	-177.6	173.9	-177.5	0	112.1
126	N	32.9	Very low	33.7	Very low	146 Å²	146	155 Å²	155	78%	0.781	83%	0.827	S	S	*	*			trans	41.2	120	150.2	-61.8	8.4	0	0	0	119.8
127	K	35.9	Very low	33.8	Very low	164 Å²	164	156.2 Å²	156.2	71%	0.713	83%	0.829	S	S	*	*				179.8	144.7	106.1	-104.8	173.9	164.3	-116.2	0	113
128	E	35	Very low	33.7	Very low	147 Å²	147	152.6 Å²	152.6	69%	0.687	82%	0.824	S	S	*	*			trans	56.8	162.8	144.1	-70.8	149.4	-161.8	0	0	120.8
129	R	35	Very low	33.8	Very low	220 Å²	220	152.8 Å²	152.8	83%	0.83	83%	0.825	S	S	*	*			cis	-169.8	144.8	-48	-147.8	178.6	179.6	-175.4	0.1	108
130	K	36.1	Very low	33.6	Very low	192 Å²	192	158.4 Å²	158.4	84%	0.835	83%	0.828	S	S	*	*			trans	77.8	145.1	163.3	-62.4	-170.8	171.8	-174	0	120.8
131	A	35.8	Very low	33.5	Very low	87 Å²	87	162 Å²	162	72%	0.719	83%	0.832	S	S	*	*			trans	73.9	105.3	146.1	0	0	0	0	0	120.4
132	N	36.6	Very low	33.6	Very low	170 Å²	170	157 Å²	157	91%	0.909	83%	0.828	S	S	*	*				-152.9	162.8	96.6	-94.6	-25.6	0	0	0	110.7
133	A	31.6	Very low	33.4	Very low	102 Å²	102	153.6 Å²	153.6	84%	0.843	83%	0.827	S	S	*	*			trans	-154.7	140.8	-178.6	0	0	0	0	0	111.4
134	A	34.4	Very low	33.5	Very low	102 Å²	102	155.8 Å²	155.8	84%	0.843	83%	0.825	S	S	*	*			trans	-160.4	127.4	163.5	0	0	0	0	0	113
135	A	32.9	Very low	33.4	Very low	90 Å²	90	151.7 Å²	151.7	74%	0.744	82%	0.821	S	S	*	*			trans	11.2	124.1	155.8	0	0	0	0	0	122.1
136	V	31.6	Very low	33.2	Very low	143 Å²	143	146.3 Å²	146.3	87%	0.867	81%	0.812	S	S	*	*				-130.1	138	109.1	178.5	0	0	0	0	108.1
137	V	32.3	Very low	33.1	Very low	139 Å²	139	145.1 Å²	145.1	84%	0.842	81%	0.813	S	S	*	*			trans	-136	119.5	175.1	172.5	0	0	0	0	109.3
138	A	35.8	Very low	32.9	Very low	89 Å²	89	142.3 Å²	142.3	74%	0.736	81%	0.814	S	S	*	*			trans	-142.7	116.1	175	0	0	0	0	0	112.2
139	R	33.1	Very low	32.7	Very low	235 Å²	235	142.2 Å²	142.2	89%	0.887	82%	0.817	S	S	*	*			trans	20.3	110.4	154.1	-62.9	174.1	178.4	-179.5	-1.9	117.4
140	R	28.5	Very low	32.6	Very low	238 Å²	238	138.8 Å²	138.8	90%	0.898	82%	0.82	S	S	*	*				56.2	108.9	86.8	-76.5	-171.6	172.6	-167.8	-1	114.7
141	Q	31.1	Very low	32.4	Very low	200 Å²	200	133.5 Å²	133.5	94%	0.935	81%	0.805	S	S	*	*				-157.9	162.3	103.4	-107.1	170.7	-7.7	0	0	109.8
142	A	29.4	Very low	32.5	Very low	96 Å²	96	137.3 Å²	137.3	79%	0.793	81%	0.807	S	S	*	*			trans	-102	139.2	179.6	0	0	0	0	0	110.1
143	L	31.4	Very low	33.1	Very low	177 Å²	177	134.4 Å²	134.4	93%	0.927	80%	0.798	S	S	*	*			trans	-117.9	120.9	168.6	-73.5	172.2	0	0	0	108.9
144	T	32.3	Very low	33.6	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	79%	0.787	S	S	*	*			trans	-73.9	145.8	167.6	45.7	0	0	0	0	110.1	A146	T144-A146 PolarHBondContact O-N 3.46Å; T144-A146 VanDerWaalsContact O-N 3.13Å
145	P	33.7	Very low	33.8	Very low	131 Å²	131	137.3 Å²	137.3	85%	0.851	78%	0.784	S	S	*	*			trans	-63.7	115.4	166.9	27.8	-33	0	0	0	109.3
146	A	31.4	Very low	34	Very low	81 Å²	81	137.9 Å²	137.9	67%	0.669	78%	0.782	S	S	*	*			trans	-90.5	137.6	172.9	0	0	0	0	0	109.7	T144 S148	T144-A146 PolarHBondContact O-N 3.46Å; T144-A146 VanDerWaalsContact O-N 3.13Å; A146-S148 PolarHBondContact O-N 3.39Å
147	P	30.4	Very low	34.3	Very low	121 Å²	121	137.3 Å²	137.3	79%	0.786	78%	0.782	S	S	*	*			trans	-79.9	105.1	179.2	30.7	-33	0	0	0	111.3	L149	P147-L149 PolarHBondContact O-N 3.2Å; P147-L149 VanDerWaalsContact O-N 3.07Å
148	S	32.3	Very low	34.9	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	78%	0.782	S	S	*	*			trans	-75	89.9	173.9	36.4	0	0	0	0	111.7	A146	A146-S148 PolarHBondContact O-N 3.39Å
149	L	31.1	Very low	34.9	Very low	146 Å²	146	138.9 Å²	138.9	76%	0.764	79%	0.788	S	S	*	*			trans	-65.8	134.2	169.5	-78	160.3	0	0	0	111.5	P147	P147-L149 PolarHBondContact O-N 3.2Å; P147-L149 VanDerWaalsContact O-N 3.07Å
150	V	32.4	Very low	35.3	Very low	147 Å²	147	133.5 Å²	133.5	89%	0.891	78%	0.783	S	S	*	*			trans	-107.9	95.1	157.7	-179.3	0	0	0	0	108.8
151	T	33	Very low	35.8	Very low	82 Å²	82	131.1 Å²	131.1	50%	0.503	78%	0.783	S	S	.	*			trans	-90.3	161.2	163.3	47.6	0	0	0	0	108.7
152	H	38	Very low	36.2	Very low	167 Å²	167	130.5 Å²	130.5	77%	0.773	78%	0.777	S	S	*	*			cis	-147.6	171.6	37.9	-88.6	-80.4	0	0	0	113.9
153	P	47.8	Very low	36.5	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	78%	0.78	S	S	*	*			trans	-101.4	-145.3	-173.6	31	-13.4	0	0	0	112.1
154	P	42.4	Very low	36.8	Very low	95 Å²	95	132.8 Å²	132.8	62%	0.617	78%	0.776	S	S	*	*				-151.1	169	89.5	43.3	-27.5	0	0	0	117.1
155	H	39	Very low	37	Very low	170 Å²	170	131.6 Å²	131.6	79%	0.787	78%	0.779	S	S	*	*			trans	63.8	140.9	158.8	-57.5	-47.2	0	0	0	119.4
156	S	37.6	Very low	37.3	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	78%	0.778	S	S	*	*			cis	-162.9	148.7	-13.5	-86.1	0	0	0	0	109.3
157	P	38.2	Very low	37.3	Very low	131 Å²	131	132.9 Å²	132.9	85%	0.851	79%	0.787	S	S	*	*			trans	-118.9	141.4	171	37.3	-26.6	0	0	0	114.3
158	S	43.9	Very low	37.9	Very low	123 Å²	123	133.1 Å²	133.1	86%	0.86	79%	0.788	S	S	*	*			trans	-149.1	151.9	161.3	57.6	0	0	0	0	111.1
159	T	36.6	Very low	38	Very low	138 Å²	138	133.5 Å²	133.5	85%	0.847	79%	0.791	S	S	*	*			trans	-80.9	165.4	-167.5	19.3	0	0	0	0	114.6
160	P	41.3	Very low	38.3	Very low	123 Å²	123	130.8 Å²	130.8	80%	0.799	79%	0.789	S	S	*	*			trans	-93.8	156.3	-163.3	36.6	-36.7	0	0	0	115
161	E	39.4	Very low	38.6	Very low	188 Å²	188	130.4 Å²	130.4	88%	0.879	79%	0.787	S	S	*	*			trans	-137.7	167.3	156.6	-166.1	151.3	-140.3	0	0	111.2
162	K	38.4	Very low	38.7	Very low	187 Å²	187	135.3 Å²	135.3	81%	0.813	80%	0.804	S	S	*	*			trans	-86.7	150.8	-165.7	-54.5	154.4	-174	161.8	0	111.8
163	T	37.1	Very low	39.5	Very low	141 Å²	141	133 Å²	133	87%	0.865	81%	0.805	S	S	*	*				-171.1	159.9	119.4	-76.7	0	0	0	0	110.9
164	Q	36.9	Very low	39.3	Very low	180 Å²	180	134 Å²	134	84%	0.841	81%	0.811	S	S	*	*			trans	-80.4	157.9	-156.7	-62.6	160.4	-28	0	0	117
165	A	36.1	Very low	39	Very low	98 Å²	98	134.9 Å²	134.9	81%	0.81	82%	0.819	S	S	*	*			trans	63.6	111.2	139.7	0	0	0	0	0	121.7
166	A	40.4	Very low	39.7	Very low	102 Å²	102	133 Å²	133	84%	0.843	82%	0.822	S	S	*	*				-173.4	149.2	102.5	0	0	0	0	0	112.4
167	T	31.8	Very low	39.8	Very low	137 Å²	137	133 Å²	133	84%	0.84	83%	0.828	S	S	*	*			trans	-130.7	147.4	168.3	-12.6	0	0	0	0	107.9
168	P	41.3	Very low	40.3	Very low	126 Å²	126	133.7 Å²	133.7	82%	0.818	83%	0.83	S	S	*	*				-149.7	172	87.7	38.7	-20.1	0	0	0	117.2
169	S	36	Very low	40.3	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	83%	0.828	S	S	*	*			trans	-37.5	144.8	172.2	-176	0	0	0	0	119.3
170	A	36.8	Very low	40.2	Very low	88 Å²	88	136.8 Å²	136.8	73%	0.727	83%	0.83	S	S	*	*				-171.1	119.4	127.6	0	0	0	0	0	115.3
171	T	38.8	Very low	40.2	Very low	140 Å²	140	139.1 Å²	139.1	86%	0.859	84%	0.836	S	S	*	*			trans	46.4	141.3	134.6	-37.3	0	0	0	0	123.9
172	Q	34.7	Very low	40.1	Very low	184 Å²	184	133.1 Å²	133.1	86%	0.86	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.8	158.4	174	-58.6	172.1	-57.9	0	0	114.8
173	P	54.4	Low	40	Very low	120 Å²	120	135.4 Å²	135.4	78%	0.779	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-102.8	147.6	158.8	36.9	-29.9	0	0	0	113.5
174	P	44.6	Very low	40	Very low	130 Å²	130	134.3 Å²	134.3	84%	0.844	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-98.7	170.1	176.5	38.2	-35.1	0	0	0	114.6
175	S	36.8	Very low	40.1	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-73.1	152.7	-178.6	-49.1	0	0	0	0	115
176	P	53.6	Low	40.2	Very low	130 Å²	130	133.2 Å²	133.2	84%	0.844	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-83.7	157.8	170.5	35.2	-35	0	0	0	112.9
177	A	38	Very low	40.2	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	82%	0.816	S	S	*	*			trans	-112.7	164	171.7	0	0	0	0	0	111.3
178	V	48.6	Very low	40.5	Very low	146 Å²	146	132.9 Å²	132.9	89%	0.885	82%	0.817	S	S	*	*			trans	-129.4	137.9	173.2	-178.6	0	0	0	0	109.1
179	T	44.8	Very low	40.4	Very low	134 Å²	134	133 Å²	133	82%	0.822	82%	0.816	S	S	*	*			trans	-93.2	149.1	-175.2	46.3	0	0	0	0	113.1
180	E	34.4	Very low	40.7	Very low	192 Å²	192	133.4 Å²	133.4	90%	0.897	82%	0.816	S	S	*	*			trans	-75	148	168.8	-59.9	-177.8	109.3	0	0	112.2
181	D	41.8	Very low	40.8	Very low	173 Å²	173	137 Å²	137	93%	0.925	82%	0.822	S	S	*	*			trans	-166	167.2	136.5	-134.9	-33.5	0	0	0	111.9
182	G	36.5	Very low	40.8	Very low	62 Å²	62	142.1 Å²	142.1	64%	0.639	83%	0.826	S	S	*	*			trans	113	12	140.4	0	0	0	0	0	125.1
183	R	36.1	Very low	41.2	Very low	235 Å²	235	140.9 Å²	140.9	89%	0.887	82%	0.824	S	S	*	*			trans	60.5	145.3	152.3	-62.9	-179.5	174.6	175.7	0	123.7
184	T	38.4	Very low	40.4	Very low	117 Å²	117	142.1 Å²	142.1	72%	0.718	82%	0.823	S	S	*	*			trans	80.3	120.1	142	40.8	0	0	0	0	124.4
185	N	38.1	Very low	40.5	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	82%	0.819	S	S	*	*			trans	76.8	93.2	138	-58.6	-8.9	0	0	0	122.1
186	S	38.6	Very low	40.5	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	82%	0.82	S	S	*	*				57	151.4	112.4	-55.3	0	0	0	0	122.1
187	P	40.3	Very low	40.3	Very low	129 Å²	129	142.6 Å²	142.6	84%	0.838	82%	0.818	S	S	*	*				-125.4	162	-126.7	41.5	-30.7	0	0	0	117.7
188	A	38.4	Very low	40.6	Very low	104 Å²	104	143.7 Å²	143.7	86%	0.86	82%	0.816	S	S	*	*			trans	-157.4	141.9	160.5	0	0	0	0	0	112.9
189	T	38.8	Very low	39.9	Very low	129 Å²	129	148.5 Å²	148.5	79%	0.791	82%	0.819	S	S	*	*			trans	-86.1	155.9	162	-14.5	0	0	0	0	109.6
190	P	43	Very low	39.9	Very low	121 Å²	121	148.2 Å²	148.2	79%	0.786	82%	0.819	S	S	*	*				-151.1	177.3	94	38.9	-20.4	0	0	0	116.6
191	N	38.5	Very low	40.4	Very low	162 Å²	162	143 Å²	143	87%	0.866	82%	0.816	S	S	*	*			trans	-44.6	155.1	-179	-56.7	-18.5	0	0	0	117.1
192	R	39.7	Very low	40.1	Very low	248 Å²	248	144.2 Å²	144.2	94%	0.936	81%	0.813	S	S	*	*			trans	-135.6	140.7	160.5	-155.4	171.7	-170.3	178.4	3.3	113.2
193	I	42.1	Very low	40.2	Very low	159 Å²	159	150 Å²	150	82%	0.815	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-75.2	151.7	-166.2	-67.1	155.7	0	0	0	113.8
194	I	36.7	Very low	40.2	Very low	146 Å²	146	143 Å²	143	75%	0.749	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-95.3	135.2	168	-59.7	166.3	0	0	0	110.3
195	P	47.1	Very low	40	Very low	117 Å²	117	143.9 Å²	143.9	76%	0.76	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-101.7	145	162.6	35.6	-28.6	0	0	0	112.5
196	V	37.9	Very low	39.9	Very low	134 Å²	134	143 Å²	143	81%	0.812	82%	0.821	S	S	*	*			trans	-117.2	143.2	174.3	175.2	0	0	0	0	109.8
197	T	48.5	Very low	39.7	Very low	131 Å²	131	143 Å²	143	80%	0.804	82%	0.821	S	S	*	*			trans	-133.2	157.5	174.3	45.3	0	0	0	0	112.1
198	P	44.4	Very low	39.5	Very low	123 Å²	123	141.9 Å²	141.9	80%	0.799	82%	0.822	S	S	*	*			trans	-105.9	167	-150.6	39.4	-36.3	0	0	0	116.9
199	R	33.9	Very low	39.4	Very low	247 Å²	247	142.9 Å²	142.9	93%	0.932	82%	0.823	S	S	*	*			trans	-86.2	153	167.5	-84.6	-173	172.5	-165.7	-0.6	113
200	P	44.9	Very low	39.2	Very low	129 Å²	129	141.2 Å²	141.2	84%	0.838	82%	0.823	S	S	*	*			trans	-130	169.3	143	38.3	-27.1	0	0	0	113.4
201	G	44.3	Very low	39.2	Very low	81 Å²	81	141.7 Å²	141.7	84%	0.835	83%	0.826	S	S	*	*			trans	110	130.6	161.5	0	0	0	0	0	117.2
202	K	35.6	Very low	39	Very low	199 Å²	199	139.1 Å²	139.1	87%	0.865	82%	0.82	S	S	*	*			trans	-120.4	152.5	165.2	-64	176.4	178.4	177.1	0	108
203	H	38.3	Very low	39	Very low	183 Å²	183	132.8 Å²	132.8	85%	0.847	81%	0.812	S	S	*	*				-175.6	133	129.7	-105.5	-75.4	0	0	0	113.9
204	S	36	Very low	38.6	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	81%	0.809	S	S	*	*			trans	31.8	112	150.1	51.6	0	0	0	0	123.3
205	T	35.1	Very low	38.6	Very low	134 Å²	134	131.6 Å²	131.6	82%	0.822	81%	0.806	S	S	*	*				52.9	112.2	128.2	60.8	0	0	0	0	121.7
206	S	35.2	Very low	38	Very low	120 Å²	120	131.5 Å²	131.5	84%	0.839	81%	0.806	S	S	*	*				-179.8	171.8	98.3	48.8	0	0	0	0	112.8
207	S	35.6	Very low	37.6	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	80%	0.803	S	S	*	*			trans	-36.2	122.1	-176.3	50.4	0	0	0	0	119.5
208	A	36	Very low	36.6	Very low	104 Å²	104	138 Å²	138	86%	0.86	81%	0.808	S	S	*	*				-172.9	135.2	127.7	0	0	0	0	0	110.3
209	S	35.2	Very low	35.8	Very low	125 Å²	125	140.8 Å²	140.8	87%	0.874	81%	0.81	S	S	*	*			trans	-98.5	119.2	179.8	54.5	0	0	0	0	112.2
210	A	35.2	Very low	35.5	Very low	95 Å²	95	136.9 Å²	136.9	79%	0.785	80%	0.803	S	S	*	*			trans	-135.7	126.1	168.6	0	0	0	0	0	109.8
211	P	43.5	Very low	34.8	Very low	130 Å²	130	135.5 Å²	135.5	84%	0.844	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-81.9	161.5	-177.9	32.4	-34.6	0	0	0	113.5
212	S	34.5	Very low	34.2	Very low	108 Å²	108	140.8 Å²	140.8	76%	0.755	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-59.2	150.6	178.8	179.6	0	0	0	0	113.6
213	P	39.8	Very low	33.9	Very low	116 Å²	116	139.1 Å²	139.1	75%	0.753	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-62.7	161.9	171.3	27.1	-36.2	0	0	0	114
214	F	33.3	Very low	33.8	Very low	173 Å²	173	134.4 Å²	134.4	76%	0.759	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-61.4	143.7	-169.8	-72.1	-102.4	0	0	0	116
215	P	37.2	Very low	33.5	Very low	107 Å²	107	137.2 Å²	137.2	70%	0.695	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.9	158.1	147	34.7	-32.9	0	0	0	110.2	Q217	P215-Q217 PolarHBondContact O-N 3.42Å
216	P	33.1	Very low	33.2	Very low	115 Å²	115	134.5 Å²	134.5	75%	0.747	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-61	126.7	-173.1	24.3	-34.5	0	0	0	112.5	W218	P216-W218 PolarHBondContact O-N 3Å; P216-W218 VanDerWaalsContact O-N 3.1Å
217	Q	29.7	Very low	32.9	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	76%	0.763	S	S	*	*			trans	-64.5	109.8	168	-77.1	-177.8	-34.7	0	0	109.3	P215 Q219	P215-Q217 PolarHBondContact O-N 3.42Å; Q217-Q219 PolarHBondContact O-N 3.16Å; Q217-Q219 VanDerWaalsContact O-N 3.13Å
218	W	27.3	Very low	32.4	Very low	240 Å²	240	136.8 Å²	136.8	91%	0.909	76%	0.762	S	S	*	*			trans	-63.4	109.8	154.3	-75.4	79.5	0	0	0	107	P216 Q220	P216-W218 PolarHBondContact O-N 3Å; P216-W218 VanDerWaalsContact O-N 3.1Å; W218-Q220 PolarHBondContact O-N 3.28Å
219	Q	28.2	Very low	32.1	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-59	121.5	166.8	-72.7	-177.2	-23.9	0	0	107.3	Q217	Q217-Q219 PolarHBondContact O-N 3.16Å; Q217-Q219 VanDerWaalsContact O-N 3.13Å
220	Q	27.8	Very low	31.7	Very low	166 Å²	166	136.7 Å²	136.7	78%	0.776	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-55.7	147	165.2	-70.9	177	-45.4	0	0	108.2	W218 K222	W218-Q220 PolarHBondContact O-N 3.28Å; Q220-K222 PolarHBondContact O-N 2.92Å
221	P	30	Very low	31.3	Very low	100 Å²	100	141.2 Å²	141.2	65%	0.649	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-49.3	137	164.4	-22.5	33.3	0	0	0	108.8	Q223	P221-Q223 PolarHBondContact O-N 3.33Å
222	K	32.1	Very low	30.6	Very low	192 Å²	192	140.4 Å²	140.4	84%	0.835	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-52	133	171	-73.9	-178.7	177.5	177.1	0	108	Q220 V224	Q220-K222 PolarHBondContact O-N 2.92Å; K222-V224 PolarHBondContact O-N 3.39Å
223	Q	29.3	Very low	30.2	Very low	164 Å²	164	140 Å²	140	77%	0.766	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-54.3	125	174.8	-68	175.5	-91.8	0	0	109	P221 E225	P221-Q223 PolarHBondContact O-N 3.33Å; Q223-E225 HydrophobicContact CB-CG 4.23Å; Q223-E225 PolarHBondContact O-N 3.48Å
224	V	35.3	Very low	29.7	Very low	84 Å²	84	140 Å²	140	51%	0.509	74%	0.738	S	S	.	*			trans	-81.8	65.7	175.4	-171.4	0	0	0	0	108.4	K222 L227	K222-V224 PolarHBondContact O-N 3.39Å; V224-L227 HydrophobicContact CG1-CD1 4.46Å
225	E	30.8	Very low	29.4	Very low	149 Å²	149	135.7 Å²	135.7	70%	0.696	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	138.5	168	-65.8	-166.7	139	0	0	109.5	Q223	Q223-E225 HydrophobicContact CB-CG 4.23Å; Q223-E225 PolarHBondContact O-N 3.48Å
226	G	28.4	Very low	29	Very low	76 Å²	76	139 Å²	139	78%	0.784	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.7	37.7	165.6	0	0	0	0	0	116.6	E228	G226-E228 PolarHBondContact O-N 3.05Å
227	L	28.2	Very low	28.7	Very low	115 Å²	115	145.2 Å²	145.2	60%	0.602	76%	0.757	S	S	*	*			trans	-74	68.1	159	-128.9	172.6	0	0	0	109.9	V224 I229	V224-L227 HydrophobicContact CG1-CD1 4.46Å; L227-I229 PolarHBondContact O-N 2.93Å; L227-I229 VanDerWaalsContact O-N 3.12Å
228	E	26.7	Very low	28.7	Very low	172 Å²	172	144.7 Å²	144.7	80%	0.804	76%	0.758	S	S	*	*			trans	-59.9	112.5	163.6	-82	-163.9	140.5	0	0	107.9	G226 V230	G226-E228 PolarHBondContact O-N 3.05Å; E228-V230 VanDerWaalsContact C-N 3.32Å; E228-V230 PolarHBondContact O-N 2.92Å
229	I	29	Very low	28.9	Very low	125 Å²	125	136.1 Å²	136.1	64%	0.641	74%	0.735	S	S	*	*			trans	-71.1	94.8	173.5	-58.4	176	0	0	0	107	L227 E231	L227-I229 PolarHBondContact O-N 2.93Å; L227-I229 VanDerWaalsContact O-N 3.12Å; I229-E231 PolarHBondContact O-N 3.26Å
230	V	27.5	Very low	29.1	Very low	102 Å²	102	132.6 Å²	132.6	62%	0.618	74%	0.736	S	S	*	*			trans	-58.8	118.5	163.7	178.5	0	0	0	0	107.1	E228 V232	E228-V230 VanDerWaalsContact C-N 3.32Å; E228-V230 PolarHBondContact O-N 2.92Å; V230-V232 VanDerWaalsContact C-N 3.27Å; V230-V232 HydrophobicContact CG1-CG2 4.42Å; V230-V232 PolarHBondContact O-N 2.95Å
231	E	25	Very low	29.4	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	74%	0.736	S	S	*	*			trans	-63.5	86.4	173.6	-71.8	-172	121.5	0	0	110.2	I229 A233	I229-E231 PolarHBondContact O-N 3.26Å; E231-A233 PolarHBondContact O-N 2.8Å
232	V	29.6	Very low	29.7	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.685	73%	0.732	S	S	*	*			trans	-76.3	111.3	167.9	-179	0	0	0	0	107.1	V230 T234	V230-V232 VanDerWaalsContact C-N 3.27Å; V230-V232 HydrophobicContact CG1-CG2 4.42Å; V230-V232 PolarHBondContact O-N 2.95Å; V232-T234 PolarHBondContact O-N 2.9Å
233	A	25.3	Very low	29.8	Very low	99 Å²	99	130.3 Å²	130.3	82%	0.818	73%	0.732	S	S	*	*			trans	-73.7	76.6	-164.5	0	0	0	0	0	114.4	E231 G235	E231-A233 PolarHBondContact O-N 2.8Å; A233-G235 PolarHBondContact O-N 2.67Å
234	T	30.4	Very low	29.7	Very low	116 Å²	116	125.3 Å²	125.3	71%	0.712	73%	0.725	S	S	*	*			trans	-74.7	114.5	149.7	50	0	0	0	0	108	V232 E236	V232-T234 PolarHBondContact O-N 2.9Å; T234-E236 PolarHBondContact O-N 3.2Å
235	G	25.7	Very low	29.5	Very low	82 Å²	82	129.2 Å²	129.2	85%	0.845	74%	0.742	S	S	*	*			trans	-67.8	17.2	-165.4	0	0	0	0	0	117.7	A233 R237	A233-G235 PolarHBondContact O-N 2.67Å; G235-R237 PolarHBondContact O-N 3.26Å
236	E	29.7	Very low	29.5	Very low	177 Å²	177	128 Å²	128	83%	0.827	74%	0.739	S	S	*	*			trans	-89.5	100.8	-177.3	-62.7	-163	132.1	0	0	111.3	T234 L238	T234-E236 PolarHBondContact O-N 3.2Å; E236-L238 PolarHBondContact O-N 3.14Å; E236-L238 VanDerWaalsContact O-N 3.12Å
237	R	26.2	Very low	29.4	Very low	246 Å²	246	133.1 Å²	133.1	93%	0.928	74%	0.742	S	S	*	*			trans	-69.4	103.9	165.8	-80.7	-178.8	167.9	172.7	-3.9	110	G235	G235-R237 PolarHBondContact O-N 3.26Å
238	L	31	Very low	29.6	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	76%	0.756	S	S	*	*			trans	-56.1	146.9	154	-73.2	174.7	0	0	0	109.7	E236	E236-L238 PolarHBondContact O-N 3.14Å; E236-L238 VanDerWaalsContact O-N 3.12Å
239	S	29.9	Very low	29.8	Very low	60 Å²	60	134.9 Å²	134.9	42%	0.42	76%	0.759	S	S	.	*			trans	-87.8	158.8	-169.3	81.1	0	0	0	0	111.2	H241 D242	S239-H241 PolarHBondContact O-N 3.01Å; S239-H241 PolarHBondContact OG-N 2.94Å; S239-D242 PolarHBondContact N-OD2 2.66Å; S239-D242 PolarHBondContact O-N 3Å; S239-D242 PolarHBondContact OG-OD2 3.03Å
240	A	32.7	Very low	29.7	Very low	106 Å²	106	132.5 Å²	132.5	88%	0.876	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	8.6	173.8	0	0	0	0	0	114
241	H	35.4	Very low	29.9	Very low	165 Å²	165	133.2 Å²	133.2	76%	0.764	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-23.5	172.7	-96.7	-79.9	0	0	0	113.4	S239 V243 G244	S239-H241 PolarHBondContact O-N 3.01Å; S239-H241 PolarHBondContact OG-N 2.94Å; H241-V243 PolarHBondContact O-N 3.36Å; H241-G244 PolarHBondContact O-N 2.68Å
242	D	35.3	Very low	30.2	Very low	108 Å²	108	129.5 Å²	129.5	58%	0.578	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	4.8	-169.3	-53.4	-63.6	0	0	0	113.6	S239	S239-D242 PolarHBondContact N-OD2 2.66Å; S239-D242 PolarHBondContact O-N 3Å; S239-D242 PolarHBondContact OG-OD2 3.03Å
243	V	34.6	Very low	30.1	Very low	137 Å²	137	127.9 Å²	127.9	83%	0.83	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	5	179.6	-161.7	0	0	0	0	111.5	H241	H241-V243 PolarHBondContact O-N 3.36Å
244	G	27.8	Very low	30.2	Very low	59 Å²	59	130.4 Å²	130.4	61%	0.608	77%	0.768	S	S	*	*			trans	-104	39.9	-170.7	0	0	0	0	0	115.4	H241	H241-G244 PolarHBondContact O-N 2.68Å
245	L	30.1	Very low	30.3	Very low	167 Å²	167	131.5 Å²	131.5	87%	0.874	78%	0.775	S	S	*	*			trans	-130.9	31.7	-173.3	-117.2	161.5	0	0	0	114.7
246	I	30.2	Very low	30.4	Very low	123 Å²	123	132.7 Å²	132.7	63%	0.631	77%	0.77	S	S	*	*	S	Bend	trans	-116.7	147.1	154.8	-59.6	178.5	0	0	0	105.8
247	E	28	Very low	30.4	Very low	183 Å²	183	128.7 Å²	128.7	86%	0.855	77%	0.767	S	S	*	*			trans	64.2	81.7	-165.3	-57.6	-160.2	130.3	0	0	116.1
248	M	31.5	Very low	30.4	Very low	182 Å²	182	126.4 Å²	126.4	90%	0.897	77%	0.767	S	S	*	*				-162.1	108.3	127.4	-94.5	-124.4	-75.1	0	0	113
249	V	30.8	Very low	30.5	Very low	142 Å²	142	125.1 Å²	125.1	86%	0.861	77%	0.771	S	S	*	*			trans	9	117.4	150	-169.4	0	0	0	0	117.5
250	G	26.4	Very low	30.5	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	79%	0.788	S	S	*	*			trans	-85.6	146.2	171.5	0	0	0	0	0	114.4
251	S	31.7	Very low	30.4	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	78%	0.783	S	S	*	*			trans	-157.6	148.1	157	67.2	0	0	0	0	112.8
252	S	31	Very low	30	Very low	111 Å²	111	129.4 Å²	129.4	78%	0.776	78%	0.784	S	S	*	*			trans	46.4	98.5	152	-168.2	0	0	0	0	121.3
253	A	28.5	Very low	29.9	Very low	80 Å²	80	129.9 Å²	129.9	66%	0.661	80%	0.796	S	S	*	*				44.4	136.9	122.6	0	0	0	0	0	123.5
254	D	26.7	Very low	29.5	Very low	151 Å²	151	127.7 Å²	127.7	81%	0.807	79%	0.787	S	S	*	*			trans	60	118.3	149.3	-54.6	-16.9	0	0	0	121.1
255	V	32.8	Very low	29.5	Very low	139 Å²	139	132.1 Å²	132.1	84%	0.842	80%	0.796	S	S	*	*				177.5	146	99.3	156.4	0	0	0	0	112
256	S	27.6	Very low	29.6	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	79%	0.792	S	S	*	*			trans	-31.3	134.4	176.7	-48.9	0	0	0	0	121.3
257	A	30.2	Very low	29.4	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	80%	0.803	S	S	*	*				34.6	125.4	125.9	0	0	0	0	0	121.9
258	E	26.6	Very low	29.7	Very low	197 Å²	197	131.3 Å²	131.3	92%	0.921	80%	0.797	S	S	*	*				171.3	111.9	113.7	-96.8	-173.5	-167.9	0	0	112.4
259	S	33.6	Very low	29.6	Very low	124 Å²	124	129.8 Å²	129.8	87%	0.867	79%	0.792	S	S	*	*			trans	-162.7	119.8	147.8	63.5	0	0	0	0	112.3
260	S	28.9	Very low	29.7	Very low	110 Å²	110	130.4 Å²	130.4	77%	0.769	79%	0.791	S	S	*	*			trans	-89.7	156.9	165.4	-175.3	0	0	0	0	110.1
261	V	31.7	Very low	30	Very low	127 Å²	127	131.8 Å²	131.8	77%	0.77	79%	0.786	S	S	*	*				-174.2	125.1	122.5	144.3	0	0	0	0	112.5
262	K	26.3	Very low	30.2	Very low	183 Å²	183	132.2 Å²	132.2	80%	0.796	79%	0.786	S	S	*	*			trans	16.4	127.3	151	-48.8	177.3	-179.1	-177.2	0	120.2
263	S	32.1	Very low	30.4	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	79%	0.793	S	S	*	*				-134.1	144.7	123.4	-171.8	0	0	0	0	109.1
264	S	27.3	Very low	30.3	Very low	91 Å²	91	141.1 Å²	141.1	64%	0.636	80%	0.802	S	S	*	*			trans	-144	119.9	-174	52.6	0	0	0	0	110.2
265	L	28.4	Very low	30.6	Very low	152 Å²	152	142.1 Å²	142.1	80%	0.796	81%	0.806	S	S	*	*			trans	-112.6	102.7	168.6	-96.9	74	0	0	0	109.2
266	D	30.7	Very low	30.3	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	81%	0.805	S	S	*	*			trans	-78	123	167.9	-69.1	-62.2	0	0	0	109.8	A268	D266-A268 PolarHBondContact O-N 2.64Å
267	Y	27.8	Very low	30.6	Very low	217 Å²	217	143.8 Å²	143.8	85%	0.851	81%	0.812	S	S	*	*			trans	-84.8	92.1	172.3	-111.3	-84	0	0	0	110
268	A	32.6	Very low	30.5	Very low	88 Å²	88	144.2 Å²	144.2	73%	0.727	81%	0.81	S	S	*	*			trans	-107.8	111.4	172.7	0	0	0	0	0	110.4	D266	D266-A268 PolarHBondContact O-N 2.64Å
269	N	29.8	Very low	30.7	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	80%	0.798	S	S	*	*			trans	-92.7	114.6	170.8	-77	-65	0	0	0	109.4
270	D	32.6	Very low	30.5	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	80%	0.797	S	S	*	*			trans	-124.7	133.3	168.3	-105.6	-42.1	0	0	0	110.4
271	P	32.9	Very low	30.6	Very low	104 Å²	104	149 Å²	149	68%	0.675	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.3	148.9	-178.7	33.3	-34.4	0	0	0	112.4	Q273	P271-Q273 PolarHBondContact O-N 3.13Å
272	P	36.5	Very low	30.6	Very low	127 Å²	127	151.8 Å²	151.8	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-72.9	130	-176.1	28.9	-34.8	0	0	0	112.7
273	Q	34.1	Very low	30.8	Very low	195 Å²	195	149.4 Å²	149.4	91%	0.911	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.2	146.5	169.9	-68.5	-173.4	-6.2	0	0	111.7	P271	P271-Q273 PolarHBondContact O-N 3.13Å
274	Q	27.7	Very low	30.8	Very low	184 Å²	184	148 Å²	148	86%	0.86	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.1	133.5	176.2	-64.9	177.2	-14.2	0	0	111
275	L	31.8	Very low	30.9	Very low	171 Å²	171	150.5 Å²	150.5	90%	0.895	82%	0.815	S	S	*	*			trans	-131	122.1	162.1	-89.5	170.1	0	0	0	110.3
276	T	26.9	Very low	30.9	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	81%	0.813	S	S	*	*			trans	-101.7	128.5	-179.9	46.2	0	0	0	0	110.7
277	V	33.3	Very low	30.7	Very low	150 Å²	150	152 Å²	152	91%	0.909	82%	0.818	S	S	*	*			trans	-135.4	145.1	166	-174.9	0	0	0	0	109.1
278	S	29.2	Very low	30.7	Very low	103 Å²	103	145.5 Å²	145.5	72%	0.72	81%	0.81	S	S	*	*			trans	-119.8	136.4	-171.6	177.4	0	0	0	0	111.3
279	S	31.1	Very low	30.8	Very low	98 Å²	98	147.9 Å²	147.9	69%	0.685	82%	0.815	S	S	*	*				161.8	131.9	106.6	56.5	0	0	0	0	116.4
280	K	29.5	Very low	30.9	Very low	194 Å²	194	148.8 Å²	148.8	84%	0.843	82%	0.815	S	S	*	*			trans	53	141.4	137.4	-62.3	179.3	178.8	176.9	0	122.4
281	R	30.2	Very low	31.2	Very low	238 Å²	238	146.1 Å²	146.1	90%	0.898	81%	0.806	S	S	*	*			trans	84.8	134.8	167.9	-61	173.9	170.4	177.4	-2.4	114.4
282	K	32	Very low	31.1	Very low	187 Å²	187	146.3 Å²	146.3	81%	0.813	81%	0.805	S	S	*	*			cis	-147.6	152.2	-8.1	-103.7	176.8	-179	-176.7	0	107.1
283	P	30.6	Very low	31.3	Very low	133 Å²	133	144.9 Å²	144.9	86%	0.864	78%	0.783	S	S	*	*			trans	-74.2	131.4	172.1	31	-32.9	0	0	0	111
284	A	32.9	Very low	31.8	Very low	89 Å²	89	138.6 Å²	138.6	74%	0.736	76%	0.758	S	S	*	*			trans	-109.3	136.6	165.6	0	0	0	0	0	108.7	V286	A284-V286 PolarHBondContact O-N 2.9Å
285	V	27.6	Very low	32.6	Very low	143 Å²	143	133.6 Å²	133.6	87%	0.867	73%	0.732	S	S	*	*			trans	-82.6	114.7	-176.6	178.4	0	0	0	0	109.7
286	V	29.1	Very low	32.7	Very low	124 Å²	124	129.3 Å²	129.3	75%	0.752	71%	0.709	S	S	*	*			trans	-123.7	117.2	168.9	-178.2	0	0	0	0	108.3	A284 A288	A284-V286 PolarHBondContact O-N 2.9Å; V286-A288 VanDerWaalsContact C-N 3.34Å; V286-A288 PolarHBondContact O-N 3.44Å; V286-A288 VanDerWaalsContact O-N 3.1Å
287	K	26.9	Very low	32.9	Very low	209 Å²	209	128.5 Å²	128.5	91%	0.909	70%	0.7	S	S	*	*			trans	-77.7	85.5	168.8	-77	-176.5	174.1	-178.6	0	109
288	A	28.8	Very low	32.7	Very low	82 Å²	82	123.9 Å²	123.9	68%	0.678	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-86.1	116.9	164.6	0	0	0	0	0	108.9	V286 E290	V286-A288 VanDerWaalsContact C-N 3.34Å; V286-A288 PolarHBondContact O-N 3.44Å; V286-A288 VanDerWaalsContact O-N 3.1Å; A288-E290 PolarHBondContact O-N 2.93Å
289	T	33.6	Very low	32.8	Very low	137 Å²	137	127.5 Å²	127.5	84%	0.84	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69.8	118	164	43.5	0	0	0	0	108.3
290	E	31.4	Very low	33	Very low	170 Å²	170	126.6 Å²	126.6	79%	0.794	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-61.7	131.4	178.9	-67.5	-171.3	127.9	0	0	110.6	A288 T292	A288-E290 PolarHBondContact O-N 2.93Å; E290-T292 PolarHBondContact O-N 3.48Å
291	P	39.2	Very low	33.6	Very low	98 Å²	98	124.2 Å²	124.2	64%	0.636	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-70.3	130	172.3	29.1	-33	0	0	0	109.8	R293	P291-R293 PolarHBondContact O-N 3.39Å
292	T	30.9	Very low	34.1	Very low	108 Å²	108	120.2 Å²	120.2	66%	0.663	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-64.4	118.9	-172.9	-28.1	0	0	0	0	111.6	E290 V294 N297	E290-T292 PolarHBondContact O-N 3.48Å; T292-V294 PolarHBondContact O-N 3.04Å; T292-V294 VanDerWaalsContact O-N 3.1Å; T292-N297 WeakPolarHBondContact CG2-OD1 2.94Å
293	R	40	Very low	34.8	Very low	97 Å²	97	113.5 Å²	113.5	37%	0.366	67%	0.666	S	S	.	*			trans	-72.6	100.5	176.6	-76.7	-178.8	164.5	-168.6	-6.6	110.5	P291 W295 L296 N297 E307	P291-R293 PolarHBondContact O-N 3.39Å; R293-W295 VanDerWaalsContact C-N 3.31Å; R293-W295 PolarHBondContact O-N 3.31Å; R293-W295 VanDerWaalsContact O-N 3.15Å; R293-L296 HydrophobicContact CB-CB 4.19Å; R293-L296 CarbonylContact O-C 3.42Å; R293-L296 PolarHBondContact O-N 3.26Å; R293-L296 VanDerWaalsContact O-N 3.09Å; R293-N297 PolarHBondContact O-N 3.21Å; R293-N297 PolarHBondContact O-ND2 3.33Å; R293-N297 VanDerWaalsContact O-ND2 3.17Å; R293-E307 IonicContact CZ-OE1 3.75Å; R293-E307 VanDerWaalsContact CZ-OE1 3.3Å; R293-E307 IonicContact NH1-OE1 2.99Å; R293-E307 PolarHBondContact NH1-OE1 2.63Å; R293-E307 IonicContact NH2-OE1 2.65Å; R293-E307 PolarHBondContact NH2-OE1 3.35Å
294	V	45.9	Very low	36.3	Very low	63 Å²	63	114.6 Å²	114.6	38%	0.382	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-47.2	-47.3	-172	-177.2	0	0	0	0	113.4	T292 N297	T292-V294 PolarHBondContact O-N 3.04Å; T292-V294 VanDerWaalsContact O-N 3.1Å; V294-N297 PolarHBondContact O-ND2 2.95Å
295	W	44.7	Very low	37.7	Very low	80 Å²	80	114.1 Å²	114.1	30%	0.303	65%	0.654	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.5	-7.5	-176.4	-74.1	100.8	0	0	0	115.7	R293 E373 R400 N401 Y608	R293-W295 VanDerWaalsContact C-N 3.31Å; R293-W295 PolarHBondContact O-N 3.31Å; R293-W295 VanDerWaalsContact O-N 3.15Å; W295-E373 WeakPolarHBondContact CB-OE2 3.38Å; W295-R400 HydrophobicContact CZ2-CB 3.94Å; W295-R400 HydrophobicContact CZ2-CG 4.31Å; W295-N401 VanDerWaalsContact CH2-OD1 3.25Å; W295-N401 WeakPolarHBondContact CH2-OD1 3.48Å; W295-N401 VanDerWaalsContact CZ2-OD1 3.32Å; W295-N401 WeakPolarHBondContact CZ2-OD1 3.34Å; W295-Y608 HydrophobicContact CH2-CD1 4.13Å; W295-Y608 AromaticContact CH2-CE1 3.54Å; W295-Y608 HydrophobicContact CH2-CE1 3.54Å; W295-Y608 HydrophobicContact CZ2-CE1 4.45Å; W295-Y608 HydrophobicContact CZ3-CE1 4.06Å
296	L	34	Very low	39.1	Very low	81 Å²	81	109.2 Å²	109.2	42%	0.424	63%	0.632	S	S	.	*			trans	-120.3	42.8	179	-77.9	172.6	0	0	0	111.8	R293 G298	R293-L296 HydrophobicContact CB-CB 4.19Å; R293-L296 CarbonylContact O-C 3.42Å; R293-L296 PolarHBondContact O-N 3.26Å; R293-L296 VanDerWaalsContact O-N 3.09Å; L296-G298 PolarHBondContact O-N 2.88Å
297	N	30.2	Very low	40.4	Very low	114 Å²	114	106.6 Å²	106.6	61%	0.61	61%	0.611	S	S	*	*			trans	-76.5	58	173.6	-80.7	-52.3	0	0	0	112.7	T292 R293 V294	T292-N297 WeakPolarHBondContact CG2-OD1 2.94Å; R293-N297 PolarHBondContact O-N 3.21Å; R293-N297 PolarHBondContact O-ND2 3.33Å; R293-N297 VanDerWaalsContact O-ND2 3.17Å; V294-N297 PolarHBondContact O-ND2 2.95Å
298	G	29	Very low	42.2	Very low	53 Å²	53	106.8 Å²	106.8	55%	0.546	61%	0.606	S	S	.	*	S	Bend	trans	-149.2	150	171.7	0	0	0	0	0	110.6	L296 A300	L296-G298 PolarHBondContact O-N 2.88Å; G298-A300 PolarHBondContact O-N 3.26Å
299	N	32.2	Very low	43.7	Very low	180 Å²	180	111 Å²	111	96%	0.963	61%	0.609	S	S	*	*			trans	-73.6	47.1	-175.6	-69.8	-35.4	0	0	0	113.6	V301	N299-V301 PolarHBondContact O-N 3.47Å
300	A	34.7	Very low	44.8	Very low	79 Å²	79	106.9 Å²	106.9	65%	0.653	58%	0.584	S	S	*	*			trans	-78	111.8	179.8	0	0	0	0	0	110.8	G298 K302	G298-A300 PolarHBondContact O-N 3.26Å; A300-K302 PolarHBondContact O-N 2.91Å
301	V	41.5	Very low	45.9	Very low	143 Å²	143	100 Å²	100	87%	0.867	56%	0.559	S	S	*	*			trans	-55.3	128.8	173	177.3	0	0	0	0	109.7	N299 G303	N299-V301 PolarHBondContact O-N 3.47Å; V301-G303 PolarHBondContact O-N 3.11Å
302	K	40.2	Very low	46.6	Very low	155 Å²	155	96.2 Å²	96.2	67%	0.674	53%	0.534	S	S	*	.			trans	-51.8	88.9	-167	-69.2	-179.5	176.4	176.7	0	114.6	A300 K304	A300-K302 PolarHBondContact O-N 2.91Å; K302-K304 PolarHBondContact O-N 2.93Å
303	G	47.8	Very low	47.8	Very low	45 Å²	45	94.6 Å²	94.6	46%	0.464	53%	0.526	S	S	.	.			trans	-85.6	94.8	171.5	0	0	0	0	0	111.2	V301 A305 G306 E307	V301-G303 PolarHBondContact O-N 3.11Å; G303-A305 PolarHBondContact O-N 3.49Å; G303-G306 PolarHBondContact O-N 3.27Å; G303-E307 PolarHBondContact O-N 3.47Å
304	K	61.4	Low	48.7	Very low	156 Å²	156	90.7 Å²	90.7	68%	0.678	51%	0.513	S	S	*	.	H	α-helix	trans	-52.7	-21.1	-179.9	-68.3	-172.5	177.8	-175.6	0	115	K302 R308	K302-K304 PolarHBondContact O-N 2.93Å; K304-R308 WeakPolarHBondContact O-CB 3.48Å; K304-R308 WeakPolarHBondContact O-CD 3.27Å; K304-R308 WeakPolarHBondContact O-CG 3.32Å; K304-R308 PolarHBondContact O-N 3.4Å
305	A	63.2	Low	49.4	Very low	80 Å²	80	90.6 Å²	90.6	66%	0.661	52%	0.519	S	S	*	.	H	α-helix	trans	-72.9	-35.5	175	0	0	0	0	0	112.7	G303 F309	G303-A305 PolarHBondContact O-N 3.49Å; A305-F309 WeakPolarHBondContact O-CB 3.4Å; A305-F309 PolarHBondContact O-N 3.43Å
306	G	56.6	Low	50.6	Low	39 Å²	39	88.5 Å²	88.5	40%	0.402	52%	0.522	S	S	.	.	H	α-helix	trans	-68.5	-53.1	175.4	0	0	0	0	0	111.1	G303 R308 F309 T310	G303-G306 PolarHBondContact O-N 3.27Å; G306-R308 PolarHBondContact O-N 3.12Å; G306-R308 VanDerWaalsContact O-N 3.11Å; G306-F309 PolarHBondContact O-N 3.05Å; G306-T310 PolarHBondContact O-N 2.85Å; G306-T310 PolarHBondContact O-OG1 2.99Å; G306-T310 VanDerWaalsContact O-OG1 3.13Å
307	E	56.9	Low	52.8	Low	69 Å²	69	85.2 Å²	85.2	32%	0.322	50%	0.504	S	S	.	.	H	α-helix	trans	-56.6	-30.5	178.5	-64.6	178.9	126.5	0	0	112.9	R293 G303 G311	R293-E307 IonicContact CZ-OE1 3.75Å; R293-E307 VanDerWaalsContact CZ-OE1 3.3Å; R293-E307 IonicContact NH1-OE1 2.99Å; R293-E307 PolarHBondContact NH1-OE1 2.63Å; R293-E307 IonicContact NH2-OE1 2.65Å; R293-E307 PolarHBondContact NH2-OE1 3.35Å; G303-E307 PolarHBondContact O-N 3.47Å; E307-G311 PolarHBondContact O-N 3.42Å
308	R	63.2	Low	55.2	Low	214 Å²	214	79.8 Å²	79.8	81%	0.808	48%	0.475	S	S	*	.	H	α-helix	trans	-83	-10.8	175.7	-76.8	175.9	173.1	-171.5	-6	115.5	K304 G306	K304-R308 WeakPolarHBondContact O-CB 3.48Å; K304-R308 WeakPolarHBondContact O-CD 3.27Å; K304-R308 WeakPolarHBondContact O-CG 3.32Å; K304-R308 PolarHBondContact O-N 3.4Å; G306-R308 PolarHBondContact O-N 3.12Å; G306-R308 VanDerWaalsContact O-N 3.11Å
309	F	61.4	Low	57.9	Low	169 Å²	169	82.8 Å²	82.8	74%	0.741	48%	0.479	S	S	*	.	H	α-helix	trans	-110.2	-35	-178	-177.1	-92.4	0	0	0	111.7	A305 G306	A305-F309 WeakPolarHBondContact O-CB 3.4Å; A305-F309 PolarHBondContact O-N 3.43Å; G306-F309 PolarHBondContact O-N 3.05Å
310	T	56.1	Low	60.8	Low	51 Å²	51	77.1 Å²	77.1	31%	0.313	45%	0.446	S	S	.	.	H	α-helix	trans	-84.7	-21.1	174.5	61.8	0	0	0	0	112.8	G306 P312 R610 Q613	G306-T310 PolarHBondContact O-N 2.85Å; G306-T310 PolarHBondContact O-OG1 2.99Å; G306-T310 VanDerWaalsContact O-OG1 3.13Å; T310-P312 WeakPolarHBondContact O-CD 3.11Å; T310-R610 PolarHBondContact O-NH2 3.5Å; T310-Q613 PolarHBondContact O-NE2 2.88Å; T310-Q613 PolarHBondContact O-OE1 3.2Å
311	G	54.2	Low	63.7	Low	26 Å²	26	73.3 Å²	73.3	27%	0.268	42%	0.415	S	S	.	.	S	Bend	trans	-72	119.4	171.5	0	0	0	0	0	109.9	E307	E307-G311 PolarHBondContact O-N 3.42Å
312	P	54.2	Low	66.3	Low	18 Å²	18	68.6 Å²	68.6	12%	0.117	38%	0.382	C	S	.	.			trans	-58.4	163.2	165.9	29.8	-35.7	0	0	0	109.8	T310 V314 E317 E373	T310-P312 WeakPolarHBondContact O-CD 3.11Å; P312-V314 PolarHBondContact O-N 3.12Å; P312-E317 VanDerWaalsContact CB-OE2 3.3Å; P312-E317 WeakPolarHBondContact CB-OE2 3.16Å; P312-E317 VanDerWaalsContact CG-OE2 3.22Å; P312-E317 WeakPolarHBondContact CG-OE2 3.35Å; P312-E373 WeakPolarHBondContact CD-O 3.38Å; P312-E373 WeakPolarHBondContact CG-O 3.4Å
313	P	57	Low	69	Low	75 Å²	75	63.1 Å²	63.1	49%	0.487	37%	0.366	S	S	.	.			trans	-66.9	85.2	165.4	29.8	-33.6	0	0	0	108.7	A315 G316 E317 E617	P313-A315 PolarHBondContact O-N 3.5Å; P313-G316 PolarHBondContact O-N 2.8Å; P313-E317 PolarHBondContact O-N 3.26Å; P313-E617 VanDerWaalsContact CD-OE1 3.28Å; P313-E617 WeakPolarHBondContact CD-OE1 3.31Å; P313-E617 WeakPolarHBondContact CG-OE1 3.44Å
314	V	58.4	Low	71.4	Confident	15 Å²	15	62 Å²	62	9%	0.091	35%	0.348	C	S	.	.	H	α-helix	trans	-46.9	-37.3	-167.1	178.8	0	0	0	0	113.2	P312 A318	P312-V314 PolarHBondContact O-N 3.12Å; V314-A318 WeakPolarHBondContact O-CB 3.42Å; V314-A318 PolarHBondContact O-N 3.44Å
315	A	59.3	Low	73.1	Confident	61 Å²	61	54.6 Å²	54.6	50%	0.504	32%	0.316	S	S	.	.	H	α-helix	trans	-58.9	-47.1	175	0	0	0	0	0	113.4	P313 A318 D319	P313-A315 PolarHBondContact O-N 3.5Å; A315-A318 PolarHBondContact O-N 3.22Å; A315-D319 WeakPolarHBondContact O-CB 3.28Å; A315-D319 PolarHBondContact O-N 3.41Å
316	G	71.3	Confident	74.8	Confident	35 Å²	35	50.8 Å²	50.8	36%	0.361	29%	0.285	S	S	.	.	H	α-helix	trans	-72.3	-35.8	-177.2	0	0	0	0	0	113.9	P313 E320	P313-G316 PolarHBondContact O-N 2.8Å; G316-E320 WeakPolarHBondContact O-CG 3.36Å
317	E	79.1	Confident	76.7	Confident	13 Å²	13	50.5 Å²	50.5	6%	0.061	28%	0.278	C	S	.	.	H	α-helix	trans	-74	-35.1	172.5	-175.9	170.4	-169.7	0	0	111.8	P312 P313 L321 V375 K616	P312-E317 VanDerWaalsContact CB-OE2 3.3Å; P312-E317 WeakPolarHBondContact CB-OE2 3.16Å; P312-E317 VanDerWaalsContact CG-OE2 3.22Å; P312-E317 WeakPolarHBondContact CG-OE2 3.35Å; P313-E317 PolarHBondContact O-N 3.26Å; E317-L321 HydrophobicContact CG-CD1 3.94Å; E317-L321 HydrophobicContact CG-CG 4.47Å; E317-L321 WeakPolarHBondContact O-CB 3.24Å; E317-L321 PolarHBondContact O-N 2.93Å; E317-V375 HydrophobicContact CG-CG1 4.27Å; E317-K616 VanDerWaalsContact CD-CE 3.46Å; E317-K616 HydrophobicContact CG-CD 4.19Å; E317-K616 WeakPolarHBondContact OE1-CD 3.35Å; E317-K616 WeakPolarHBondContact OE1-CE 3.39Å
318	A	82.4	Confident	78.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-51.6	174.8	0	0	0	0	0	111.8	V314 A315 E320 L321 W322 W368 V375	V314-A318 WeakPolarHBondContact O-CB 3.42Å; V314-A318 PolarHBondContact O-N 3.44Å; A315-A318 PolarHBondContact O-N 3.22Å; A318-E320 PolarHBondContact O-N 3.45Å; A318-E320 VanDerWaalsContact O-N 3.13Å; A318-L321 PolarHBondContact O-N 3Å; A318-W322 WeakPolarHBondContact O-CB 3.45Å; A318-W322 PolarHBondContact O-N 3.17Å; A318-W322 VanDerWaalsContact O-N 3.11Å; A318-W368 HydrophobicContact CB-CD2 3.65Å; A318-W368 HydrophobicContact CB-CE3 3.67Å; A318-W368 HydrophobicContact CB-CG 4.38Å; A318-W368 HydrophobicContact CB-CH2 3.8Å; A318-W368 HydrophobicContact CB-CZ2 3.74Å; A318-W368 HydrophobicContact CB-CZ3 3.75Å; A318-V375 HydrophobicContact CB-CG2 4.23Å
319	D	83.9	Confident	80.3	Confident	116 Å²	116	37.1 Å²	37.1	62%	0.62	23%	0.225	S	C	*	.	H	α-helix	trans	-53	-34.8	-179.5	-75.5	-17.2	0	0	0	112.6	A315	A315-D319 WeakPolarHBondContact O-CB 3.28Å; A315-D319 PolarHBondContact O-N 3.41Å
320	E	93.1	Very high	82.1	Confident	60 Å²	60	31.9 Å²	31.9	28%	0.28	20%	0.201	S	C	.	.	H	α-helix	trans	-87.6	-45.5	-178.7	-65.8	-70.1	174.1	0	0	113.6	G316 A318 W411 F620	G316-E320 WeakPolarHBondContact O-CG 3.36Å; A318-E320 PolarHBondContact O-N 3.45Å; A318-E320 VanDerWaalsContact O-N 3.13Å; E320-W411 VanDerWaalsContact O-CD1 3.28Å; E320-W411 PolarHBondContact OE2-NE1 2.91Å; E320-F620 HydrophobicContact CB-CD2 4.17Å; E320-F620 HydrophobicContact CB-CE1 4.28Å; E320-F620 HydrophobicContact CB-CE2 3.86Å; E320-F620 HydrophobicContact CB-CZ 3.92Å; E320-F620 HydrophobicContact CG-CD1 4.46Å; E320-F620 HydrophobicContact CG-CD2 3.8Å; E320-F620 HydrophobicContact CG-CE2 4.02Å; E320-F620 HydrophobicContact CG-CG 4.04Å; E320-F620 HydrophobicContact CG-CZ 4.44Å
321	L	95.8	Very high	84.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-104.2	-9.6	-166.4	-65.3	-175.1	0	0	0	116.3	E317 A318 A323 H324 D325 V375 I404 L408 W411 K616 F620	E317-L321 HydrophobicContact CG-CD1 3.94Å; E317-L321 HydrophobicContact CG-CG 4.47Å; E317-L321 WeakPolarHBondContact O-CB 3.24Å; E317-L321 PolarHBondContact O-N 2.93Å; A318-L321 PolarHBondContact O-N 3Å; L321-A323 VanDerWaalsContact C-N 3.26Å; L321-A323 PolarHBondContact O-N 3.36Å; L321-A323 VanDerWaalsContact O-N 3.17Å; L321-H324 PolarHBondContact O-N 3.01Å; L321-H324 VanDerWaalsContact O-N 3.07Å; L321-D325 PolarHBondContact O-N 3.17Å; L321-D325 VanDerWaalsContact O-N 3.17Å; L321-V375 HydrophobicContact CB-CG1 4.18Å; L321-I404 HydrophobicContact CD1-CD1 3.59Å; L321-L408 HydrophobicContact CD2-CD1 4.35Å; L321-W411 HydrophobicContact CD2-CB 3.76Å; L321-W411 HydrophobicContact CD2-CG 3.88Å; L321-K616 HydrophobicContact CD1-CD 3.91Å; L321-F620 HydrophobicContact CD1-CZ 4.07Å; L321-F620 HydrophobicContact CD2-CE1 4.29Å; L321-F620 HydrophobicContact CD2-CZ 4.02Å; L321-F620 HydrophobicContact CG-CZ 3.83Å
322	W	96.1	Very high	86.2	Confident	44 Å²	44	29.1 Å²	29.1	17%	0.167	18%	0.178	C	C	.	.	H	α-helix	trans	-56.7	-38.8	-171.1	75.2	-96.1	0	0	0	113.4	A318 H324 I326 E358 I361 Q362 W368 V375 I379	A318-W322 WeakPolarHBondContact O-CB 3.45Å; A318-W322 PolarHBondContact O-N 3.17Å; A318-W322 VanDerWaalsContact O-N 3.11Å; W322-H324 VanDerWaalsContact C-N 3.32Å; W322-H324 PolarHBondContact O-N 3.26Å; W322-I326 HydrophobicContact CE3-CD1 3.81Å; W322-I326 HydrophobicContact CZ3-CD1 4.08Å; W322-I326 WeakPolarHBondContact O-CG1 3.17Å; W322-I326 PolarHBondContact O-N 3.21Å; W322-E358 HydrophobicContact CH2-CG 3.83Å; W322-E358 HydrophobicContact CZ3-CB 3.94Å; W322-E358 HydrophobicContact CZ3-CG 3.62Å; W322-I361 HydrophobicContact CB-CD1 4.23Å; W322-I361 HydrophobicContact CD2-CB 4.28Å; W322-I361 HydrophobicContact CD2-CD1 4.04Å; W322-I361 HydrophobicContact CD2-CG2 3.6Å; W322-I361 HydrophobicContact CE3-CB 4.31Å; W322-I361 HydrophobicContact CE3-CD1 3.72Å; W322-I361 HydrophobicContact CE3-CG2 4.12Å; W322-I361 HydrophobicContact CG-CD1 4.28Å; W322-I361 HydrophobicContact CG-CG2 3.84Å; W322-I361 HydrophobicContact CZ2-CG2 4.23Å; W322-Q362 HydrophobicContact CH2-CG 3.85Å; W322-Q362 HydrophobicContact CZ2-CG 4.14Å; W322-W368 HydrophobicContact CB-CH2 3.82Å; W322-W368 HydrophobicContact CB-CZ2 4.07Å; W322-V375 HydrophobicContact CB-CG2 3.98Å; W322-I379 HydrophobicContact CB-CD1 4.42Å
323	A	97.1	Very high	88.3	Confident	40 Å²	40	28.3 Å²	28.3	33%	0.331	17%	0.173	S	C	.	.	H	α-helix	trans	-68.8	-34.3	-177.8	0	0	0	0	0	111.8	L321 A327	L321-A323 VanDerWaalsContact C-N 3.26Å; L321-A323 PolarHBondContact O-N 3.36Å; L321-A323 VanDerWaalsContact O-N 3.17Å; A323-A327 WeakPolarHBondContact O-CB 3.46Å; A323-A327 PolarHBondContact O-N 3.43Å
324	H	97.9	Very high	90.3	Very high	21 Å²	21	26.3 Å²	26.3	10%	0.097	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-42.1	-179.3	-58.3	109.8	0	0	0	111.8	L321 W322 A327 C328 D407 L410 W411 D414	L321-H324 PolarHBondContact O-N 3.01Å; L321-H324 VanDerWaalsContact O-N 3.07Å; W322-H324 VanDerWaalsContact C-N 3.32Å; W322-H324 PolarHBondContact O-N 3.26Å; H324-A327 PolarHBondContact O-N 2.99Å; H324-C328 WeakPolarHBondContact O-CB 3.4Å; H324-C328 PolarHBondContact O-N 2.91Å; H324-D407 HydrophobicContact CB-CB 3.98Å; H324-L410 HydrophobicContact CB-CB 4.24Å; H324-L410 HydrophobicContact CB-CD1 4.34Å; H324-L410 VanDerWaalsContact CD2-CB 3.42Å; H324-L410 WeakPolarHBondContact CD2-CB 3.37Å; H324-W411 AromaticContact CE1-CD1 3.78Å; H324-W411 AromaticContact ND1-CD1 3.92Å; H324-D414 IonicContact CD2-OD2 2.68Å; H324-D414 IonicContact CE1-OD2 3.77Å; H324-D414 IonicContact NE2-OD2 3.36Å; H324-D414 PolarHBondContact NE2-OD2 3.1Å
325	D	97.6	Very high	92.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-42.1	173.3	177.2	35.5	0	0	0	111.9	L321 A327 C328 S329 H376 I379 Q403	L321-D325 PolarHBondContact O-N 3.17Å; L321-D325 VanDerWaalsContact O-N 3.17Å; D325-A327 PolarHBondContact O-N 2.73Å; D325-C328 PolarHBondContact O-N 3.42Å; D325-S329 WeakPolarHBondContact O-CB 3.45Å; D325-S329 PolarHBondContact O-N 2.84Å; D325-S329 PolarHBondContact O-OG 3.32Å; D325-S329 PolarHBondContact OD1-OG 3.28Å; D325-S329 VanDerWaalsContact OD1-OG 3.12Å; D325-H376 VanDerWaalsContact CG-CD2 3.46Å; D325-H376 IonicContact OD1-CD2 3.57Å; D325-H376 WeakPolarHBondContact OD2-CA 3.41Å; D325-H376 IonicContact OD2-CD2 2.73Å; D325-I379 HydrophobicContact CB-CD1 4.11Å; D325-I379 VanDerWaalsContact OD2-CD1 3.32Å; D325-I379 WeakPolarHBondContact OD2-CD1 3.29Å; D325-Q403 PolarHBondContact OD1-NE2 2.92Å
326	I	98	Very high	94.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-43.3	176.5	-65.3	-175.2	0	0	0	110.5	W322 S329 R330 L354 I357 E358 I361 I379	W322-I326 HydrophobicContact CE3-CD1 3.81Å; W322-I326 HydrophobicContact CZ3-CD1 4.08Å; W322-I326 WeakPolarHBondContact O-CG1 3.17Å; W322-I326 PolarHBondContact O-N 3.21Å; I326-S329 PolarHBondContact O-N 3.17Å; I326-R330 WeakPolarHBondContact O-CG 3.44Å; I326-R330 PolarHBondContact O-N 3.36Å; I326-L354 HydrophobicContact CG2-CB 4.16Å; I326-L354 HydrophobicContact CG2-CD2 4.35Å; I326-I357 HydrophobicContact CD1-CG2 3.97Å; I326-E358 HydrophobicContact CD1-CB 3.91Å; I326-I361 HydrophobicContact CD1-CD1 4.03Å; I326-I379 HydrophobicContact CD1-CD1 4.43Å; I326-I379 HydrophobicContact CG1-CD1 3.95Å; I326-I379 HydrophobicContact CG1-CG1 4.5Å; I326-I379 HydrophobicContact CG1-CG2 4.17Å
327	A	97.8	Very high	95.4	Very high	33 Å²	33	22.1 Å²	22.1	27%	0.273	12%	0.123	S	C	.	.	H	α-helix	trans	-62.4	-45.7	176	0	0	0	0	0	112.8	A323 H324 D325 S329 R330 V331 L507	A323-A327 WeakPolarHBondContact O-CB 3.46Å; A323-A327 PolarHBondContact O-N 3.43Å; H324-A327 PolarHBondContact O-N 2.99Å; D325-A327 PolarHBondContact O-N 2.73Å; A327-S329 VanDerWaalsContact C-N 3.34Å; A327-S329 PolarHBondContact O-N 3.29Å; A327-R330 PolarHBondContact O-N 2.93Å; A327-V331 PolarHBondContact O-N 3.33Å; A327-L507 HydrophobicContact CB-CD2 4.48Å
328	C	97.8	Very high	96.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57	-46.3	173.7	179.9	0	0	0	0	111.4	H324 D325 V331 H332 T406 D407	H324-C328 WeakPolarHBondContact O-CB 3.4Å; H324-C328 PolarHBondContact O-N 2.91Å; D325-C328 PolarHBondContact O-N 3.42Å; C328-V331 VanDerWaalsContact O-CG2 3.26Å; C328-V331 WeakPolarHBondContact O-CG2 3.33Å; C328-H332 WeakPolarHBondContact O-CB 3.47Å; C328-H332 PolarHBondContact O-N 3Å; C328-H332 VanDerWaalsContact O-N 3.11Å; C328-T406 HydrophobicContact CB-CG2 4.5Å; C328-D407 VanDerWaalsContact CB-OD1 3.26Å; C328-D407 WeakPolarHBondContact CB-OD1 3.38Å
329	S	98.3	Very high	97	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-66.6	-37.3	178.3	-69.8	0	0	0	0	113.2	D325 I326 A327 H332 A333 R398	D325-S329 WeakPolarHBondContact O-CB 3.45Å; D325-S329 PolarHBondContact O-N 2.84Å; D325-S329 PolarHBondContact O-OG 3.32Å; D325-S329 PolarHBondContact OD1-OG 3.28Å; D325-S329 VanDerWaalsContact OD1-OG 3.12Å; I326-S329 PolarHBondContact O-N 3.17Å; A327-S329 VanDerWaalsContact C-N 3.34Å; A327-S329 PolarHBondContact O-N 3.29Å; S329-H332 PolarHBondContact O-N 2.81Å; S329-A333 PolarHBondContact O-N 3.08Å; S329-R398 PolarHBondContact OG-NH1 2.96Å; S329-R398 PolarHBondContact OG-NH2 2.77Å
330	R	98.5	Very high	97.6	Very high	59 Å²	59	27 Å²	27	22%	0.223	16%	0.161	C	C	.	.	H	α-helix	trans	-62	-51.8	174.1	-74.4	-170.6	-178.4	107.6	1.8	112	I326 A327 H332 A333 V334 L351 L354 D355 E358	I326-R330 WeakPolarHBondContact O-CG 3.44Å; I326-R330 PolarHBondContact O-N 3.36Å; A327-R330 PolarHBondContact O-N 2.93Å; R330-H332 VanDerWaalsContact C-N 3.27Å; R330-H332 PolarHBondContact O-N 3.1Å; R330-A333 PolarHBondContact O-N 3.36Å; R330-V334 WeakPolarHBondContact O-CG2 3.43Å; R330-V334 PolarHBondContact O-N 3.26Å; R330-V334 VanDerWaalsContact O-N 3.17Å; R330-L351 HydrophobicContact CB-CD2 3.75Å; R330-L351 HydrophobicContact CG-CD2 3.68Å; R330-L354 HydrophobicContact CG-CB 4.47Å; R330-L354 HydrophobicContact CG-CD1 3.85Å; R330-D355 IonicContact CZ-OD1 3.32Å; R330-D355 IonicContact NE-OD1 3.64Å; R330-D355 PolarHBondContact NE-OD1 2.92Å; R330-D355 IonicContact NH2-OD1 2.74Å; R330-D355 PolarHBondContact NH2-OD1 2.95Å; R330-E358 IonicContact CZ-OE2 2.69Å; R330-E358 IonicContact NH1-OE2 3.72Å; R330-E358 PolarHBondContact NH1-OE2 2.95Å; R330-E358 IonicContact NH2-OE2 3.8Å; R330-E358 PolarHBondContact NH2-OE2 2.79Å
331	V	98.2	Very high	97.8	Very high	18 Å²	18	26.6 Å²	26.6	11%	0.109	16%	0.161	C	C	.	.	H	α-helix	trans	-65.6	-33	-178.9	-58.3	0	0	0	0	112.2	A327 C328 V334 M335 L486 T503 D506 L507	A327-V331 PolarHBondContact O-N 3.33Å; C328-V331 VanDerWaalsContact O-CG2 3.26Å; C328-V331 WeakPolarHBondContact O-CG2 3.33Å; V331-V334 PolarHBondContact O-N 2.68Å; V331-M335 WeakPolarHBondContact O-CB 3.45Å; V331-M335 PolarHBondContact O-N 3.12Å; V331-L486 HydrophobicContact CG2-CD2 4.33Å; V331-T503 HydrophobicContact CG2-CG2 4.3Å; V331-D506 HydrophobicContact CB-CB 4.27Å; V331-D506 HydrophobicContact CG1-CB 3.78Å; V331-L507 HydrophobicContact CB-CG 4.41Å; V331-L507 HydrophobicContact CG1-CD2 3.88Å; V331-L507 HydrophobicContact CG1-CG 4.03Å; V331-L507 HydrophobicContact CG2-CD1 3.68Å; V331-L507 HydrophobicContact CG2-CD2 3.89Å; V331-L507 HydrophobicContact CG2-CG 3.62Å
332	H	98.5	Very high	97.9	Very high	1 Å²	1	27 Å²	27	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-67.9	-43.5	178.5	-166	74.4	0	0	0	111.1	C328 S329 R330 V334 M335 L336 L394 T396 L486	C328-H332 WeakPolarHBondContact O-CB 3.47Å; C328-H332 PolarHBondContact O-N 3Å; C328-H332 VanDerWaalsContact O-N 3.11Å; S329-H332 PolarHBondContact O-N 2.81Å; R330-H332 VanDerWaalsContact C-N 3.27Å; R330-H332 PolarHBondContact O-N 3.1Å; H332-V334 VanDerWaalsContact C-N 3.33Å; H332-V334 PolarHBondContact O-N 2.87Å; H332-M335 VanDerWaalsContact CE1-CE 3.5Å; H332-M335 WeakPolarHBondContact CE1-CE 3.21Å; H332-M335 PolarHBondContact O-N 2.74Å; H332-L336 VanDerWaalsContact O-CG 3.32Å; H332-L336 WeakPolarHBondContact O-CG 3.14Å; H332-L336 PolarHBondContact O-N 3.29Å; H332-L394 PolarHBondContact CD2-O 3.42Å; H332-L394 VanDerWaalsContact CD2-O 3.24Å; H332-T396 PolarHBondContact NE2-O 3.34Å; H332-L486 HydrophobicContact CB-CD2 4.49Å
333	A	98.4	Very high	98	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-45	172.8	0	0	0	0	0	112.2	S329 R330 L336 A337 K347 I350 L394	S329-A333 PolarHBondContact O-N 3.08Å; R330-A333 PolarHBondContact O-N 3.36Å; A333-L336 PolarHBondContact O-N 2.86Å; A333-A337 PolarHBondContact O-N 3.03Å; A333-A337 VanDerWaalsContact O-N 3.14Å; A333-K347 HydrophobicContact CB-CG 4.5Å; A333-I350 HydrophobicContact CB-CB 4.43Å; A333-I350 HydrophobicContact CB-CG2 3.73Å; A333-L394 HydrophobicContact CB-CD1 3.82Å
334	V	98.6	Very high	98	Very high	33 Å²	33	29.9 Å²	29.9	20%	0.2	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-45.6	178.2	176.3	0	0	0	0	111.3	R330 V331 H332 A337 E338 K347 L351	R330-V334 WeakPolarHBondContact O-CG2 3.43Å; R330-V334 PolarHBondContact O-N 3.26Å; R330-V334 VanDerWaalsContact O-N 3.17Å; V331-V334 PolarHBondContact O-N 2.68Å; H332-V334 VanDerWaalsContact C-N 3.33Å; H332-V334 PolarHBondContact O-N 2.87Å; V334-A337 PolarHBondContact O-N 2.91Å; V334-E338 WeakPolarHBondContact CG1-OE1 3.31Å; V334-E338 PolarHBondContact O-N 3.09Å; V334-K347 HydrophobicContact CG2-CD 4.36Å; V334-K347 HydrophobicContact CG2-CG 4.39Å; V334-L351 HydrophobicContact CG2-CD1 4.09Å; V334-L351 HydrophobicContact CG2-CD2 4.43Å
335	M	98.4	Very high	98.1	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-63.1	-42.3	176.2	178.3	-76.7	-59.6	0	0	112.5	V331 H332 A337 E338 T339 I498 D499 K502 T503	V331-M335 WeakPolarHBondContact O-CB 3.45Å; V331-M335 PolarHBondContact O-N 3.12Å; H332-M335 VanDerWaalsContact CE1-CE 3.5Å; H332-M335 WeakPolarHBondContact CE1-CE 3.21Å; H332-M335 PolarHBondContact O-N 2.74Å; M335-A337 PolarHBondContact O-N 3.3Å; M335-E338 PolarHBondContact O-N 3.37Å; M335-T339 HydrophobicContact CG-CG2 4.47Å; M335-T339 WeakPolarHBondContact O-CB 3.49Å; M335-T339 WeakPolarHBondContact O-CG2 3.39Å; M335-T339 PolarHBondContact O-N 3.43Å; M335-T339 PolarHBondContact O-OG1 3.45Å; M335-T339 HydrophobicContact SD-CG2 3.96Å; M335-I498 HydrophobicContact CE-CB 3.89Å; M335-I498 HydrophobicContact CE-CG2 3.75Å; M335-I498 HydrophobicContact SD-CB 3.57Å; M335-I498 VanDerWaalsContact SD-CB 3.57Å; M335-I498 HydrophobicContact SD-CG2 3.7Å; M335-D499 HydrophobicContact CG-CB 4.41Å; M335-D499 WeakPolarHBondContact CG-O 3.48Å; M335-K502 HydrophobicContact CB-CD 4.03Å; M335-K502 HydrophobicContact CG-CD 4.26Å; M335-T503 HydrophobicContact CB-CG2 3.63Å; M335-T503 HydrophobicContact CG-CG2 3.87Å
336	L	98.5	Very high	98.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-31.2	175.7	-71.2	178.3	0	0	0	112.4	H332 A333 T339 G340 L341 I342 T396 A397	H332-L336 VanDerWaalsContact O-CG 3.32Å; H332-L336 WeakPolarHBondContact O-CG 3.14Å; H332-L336 PolarHBondContact O-N 3.29Å; A333-L336 PolarHBondContact O-N 2.86Å; L336-T339 WeakPolarHBondContact CA-OG1 3.43Å; L336-T339 PolarHBondContact O-OG1 2.95Å; L336-G340 PolarHBondContact O-N 2.84Å; L336-L341 HydrophobicContact CB-CB 4.41Å; L336-L341 HydrophobicContact CD2-CB 3.95Å; L336-L341 HydrophobicContact CD2-CD1 3.62Å; L336-L341 HydrophobicContact CD2-CG 4.44Å; L336-L341 WeakPolarHBondContact O-CA 3.33Å; L336-L341 PolarHBondContact O-N 2.92Å; L336-I342 HydrophobicContact CB-CD1 3.96Å; L336-I342 HydrophobicContact CB-CG1 3.84Å; L336-I342 HydrophobicContact CB-CG2 4.27Å; L336-I342 HydrophobicContact CD1-CG2 4.46Å; L336-I342 PolarHBondContact O-N 3.39Å; L336-I342 VanDerWaalsContact O-N 3.08Å; L336-T396 HydrophobicContact CD2-CG2 4.07Å; L336-A397 HydrophobicContact CD2-CB 4.49Å
337	A	98.3	Very high	98.1	Very high	22 Å²	22	33.1 Å²	33.1	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-77.8	-44	176.4	0	0	0	0	0	112.7	A333 V334 M335 T339 G340 I342 K347	A333-A337 PolarHBondContact O-N 3.03Å; A333-A337 VanDerWaalsContact O-N 3.14Å; V334-A337 PolarHBondContact O-N 2.91Å; M335-A337 PolarHBondContact O-N 3.3Å; A337-T339 PolarHBondContact O-N 2.9Å; A337-G340 PolarHBondContact O-N 2.76Å; A337-I342 HydrophobicContact CB-CG1 4Å; A337-K347 HydrophobicContact CB-CB 3.67Å; A337-K347 HydrophobicContact CB-CD 3.92Å; A337-K347 HydrophobicContact CB-CG 3.85Å
338	E	97.7	Very high	98.2	Very high	129 Å²	129	35.7 Å²	35.7	60%	0.603	22%	0.221	S	C	*	.	H	α-helix	trans	-64.3	-26.1	176.5	-73.6	174.2	-143.9	0	0	112.4	V334 M335 K502	V334-E338 WeakPolarHBondContact CG1-OE1 3.31Å; V334-E338 PolarHBondContact O-N 3.09Å; M335-E338 PolarHBondContact O-N 3.37Å; E338-K502 VanDerWaalsContact OE1-CE 3.24Å; E338-K502 WeakPolarHBondContact OE1-CE 3.42Å; E338-K502 IonicContact OE1-NZ 2.64Å; E338-K502 PolarHBondContact OE1-NZ 3.12Å; E338-K502 VanDerWaalsContact OE2-CD 3.24Å; E338-K502 WeakPolarHBondContact OE2-CD 3.5Å; E338-K502 WeakPolarHBondContact OE2-CE 3.39Å; E338-K502 IonicContact OE2-NZ 3.55Å; E338-K502 PolarHBondContact OE2-NZ 3.2Å
339	T	97.6	Very high	98.2	Very high	40 Å²	40	39.3 Å²	39.3	25%	0.245	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	2.2	174.4	55.8	0	0	0	0	114	M335 L336 A337 L341 P497	M335-T339 HydrophobicContact CG-CG2 4.47Å; M335-T339 WeakPolarHBondContact O-CB 3.49Å; M335-T339 WeakPolarHBondContact O-CG2 3.39Å; M335-T339 PolarHBondContact O-N 3.43Å; M335-T339 PolarHBondContact O-OG1 3.45Å; M335-T339 HydrophobicContact SD-CG2 3.96Å; L336-T339 WeakPolarHBondContact CA-OG1 3.43Å; L336-T339 PolarHBondContact O-OG1 2.95Å; A337-T339 PolarHBondContact O-N 2.9Å; T339-L341 VanDerWaalsContact C-N 3.26Å; T339-L341 PolarHBondContact O-N 2.67Å; T339-P497 WeakPolarHBondContact CB-O 3.48Å; T339-P497 WeakPolarHBondContact CG2-O 3.39Å
340	G	97.3	Very high	98.2	Very high	62 Å²	62	39.2 Å²	39.2	64%	0.639	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.5	10.4	176.8	0	0	0	0	0	115.6	L336 A337	L336-G340 PolarHBondContact O-N 2.84Å; A337-G340 PolarHBondContact O-N 2.76Å
341	L	97.5	Very high	98.2	Very high	52 Å²	52	38 Å²	38	27%	0.272	24%	0.237	S	C	.	.	S	Bend	trans	-76.4	-24.5	177.1	-67	170.3	0	0	0	112.4	L336 T339 T396 L496 I498	L336-L341 HydrophobicContact CB-CB 4.41Å; L336-L341 HydrophobicContact CD2-CB 3.95Å; L336-L341 HydrophobicContact CD2-CD1 3.62Å; L336-L341 HydrophobicContact CD2-CG 4.44Å; L336-L341 WeakPolarHBondContact O-CA 3.33Å; L336-L341 PolarHBondContact O-N 2.92Å; T339-L341 VanDerWaalsContact C-N 3.26Å; T339-L341 PolarHBondContact O-N 2.67Å; L341-T396 HydrophobicContact CB-CG2 4.47Å; L341-T396 HydrophobicContact CD1-CG2 4.43Å; L341-L496 HydrophobicContact CD1-CB 4.14Å; L341-L496 HydrophobicContact CD2-CB 4.4Å; L341-L496 HydrophobicContact CD2-CD1 4.39Å; L341-L496 HydrophobicContact CD2-CD2 4.17Å; L341-I498 HydrophobicContact CD1-CG2 3.98Å
342	I	97.9	Very high	98.2	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.046	26%	0.258	C	S	.	.	S	Bend	trans	-131.8	162.1	166.1	69.1	178.2	0	0	0	110.4	L336 A337 D346 K347 I350 K393	L336-I342 HydrophobicContact CB-CD1 3.96Å; L336-I342 HydrophobicContact CB-CG1 3.84Å; L336-I342 HydrophobicContact CB-CG2 4.27Å; L336-I342 HydrophobicContact CD1-CG2 4.46Å; L336-I342 PolarHBondContact O-N 3.39Å; L336-I342 VanDerWaalsContact O-N 3.08Å; A337-I342 HydrophobicContact CB-CG1 4Å; I342-D346 HydrophobicContact CB-CB 4.03Å; I342-D346 HydrophobicContact CD1-CB 4.3Å; I342-D346 HydrophobicContact CG1-CB 4.39Å; I342-K347 HydrophobicContact CD1-CB 3.9Å; I342-K347 HydrophobicContact CG1-CB 4.41Å; I342-I350 HydrophobicContact CD1-CD1 3.81Å; I342-K393 HydrophobicContact CB-CD 4.46Å; I342-K393 HydrophobicContact CG2-CB 3.56Å; I342-K393 HydrophobicContact CG2-CD 4Å; I342-K393 HydrophobicContact CG2-CG 4.34Å
343	T	98.2	Very high	98.2	Very high	83 Å²	83	42.7 Å²	42.7	51%	0.509	26%	0.258	S	S	.	.			trans	-76.2	158.1	175.6	68.5	0	0	0	0	111.4	G345 D346 K347	T343-G345 PolarHBondContact O-N 3.13Å; T343-D346 WeakPolarHBondContact CB-OD2 3.44Å; T343-D346 PolarHBondContact N-OD2 3.02Å; T343-D346 WeakPolarHBondContact O-CB 3.34Å; T343-D346 PolarHBondContact O-N 3.12Å; T343-D346 VanDerWaalsContact O-N 3.16Å; T343-D346 PolarHBondContact OG1-N 3.37Å; T343-D346 PolarHBondContact OG1-OD2 3.33Å; T343-K347 PolarHBondContact O-N 3.42Å; T343-K347 VanDerWaalsContact O-N 3.09Å
344	A	98	Very high	98.2	Very high	61 Å²	61	42.7 Å²	42.7	50%	0.504	26%	0.258	S	S	.	.	H	α-helix	trans	-55.4	-40.6	172.6	0	0	0	0	0	111.9	K347 D348	A344-K347 WeakPolarHBondContact O-CB 3.46Å; A344-K347 WeakPolarHBondContact O-CE 2.89Å; A344-K347 PolarHBondContact O-N 3.04Å; A344-D348 PolarHBondContact O-N 3.21Å
345	G	98.3	Very high	98.2	Very high	37 Å²	37	45 Å²	45	38%	0.381	27%	0.269	S	S	.	.	H	α-helix	trans	-66.1	-38.8	176.1	0	0	0	0	0	113.9	T343 K347 D348 I349	T343-G345 PolarHBondContact O-N 3.13Å; G345-K347 VanDerWaalsContact C-N 3.28Å; G345-K347 PolarHBondContact O-N 2.93Å; G345-D348 PolarHBondContact O-N 3.36Å; G345-I349 WeakPolarHBondContact O-CB 3.48Å; G345-I349 WeakPolarHBondContact O-CD1 3.47Å; G345-I349 VanDerWaalsContact O-CG1 3.24Å; G345-I349 WeakPolarHBondContact O-CG1 3.41Å; G345-I349 PolarHBondContact O-N 3.48Å
346	D	98.3	Very high	98.2	Very high	14 Å²	14	48.6 Å²	48.6	8%	0.075	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-45.6	171	-70	-61.2	0	0	0	110.7	I342 T343 I349 I350 P390 K393	I342-D346 HydrophobicContact CB-CB 4.03Å; I342-D346 HydrophobicContact CD1-CB 4.3Å; I342-D346 HydrophobicContact CG1-CB 4.39Å; T343-D346 WeakPolarHBondContact CB-OD2 3.44Å; T343-D346 PolarHBondContact N-OD2 3.02Å; T343-D346 WeakPolarHBondContact O-CB 3.34Å; T343-D346 PolarHBondContact O-N 3.12Å; T343-D346 VanDerWaalsContact O-N 3.16Å; T343-D346 PolarHBondContact OG1-N 3.37Å; T343-D346 PolarHBondContact OG1-OD2 3.33Å; D346-I349 PolarHBondContact O-N 2.93Å; D346-I350 WeakPolarHBondContact O-CB 3.47Å; D346-I350 WeakPolarHBondContact O-CD1 3.42Å; D346-I350 WeakPolarHBondContact O-CG1 3.28Å; D346-I350 PolarHBondContact O-N 3.16Å; D346-P390 HydrophobicContact CB-CB 4.28Å; D346-K393 HydrophobicContact CB-CD 4.41Å; D346-K393 IonicContact OD1-NZ 2.63Å; D346-K393 PolarHBondContact OD1-NZ 3.02Å; D346-K393 IonicContact OD2-NZ 3.28Å; D346-K393 PolarHBondContact OD2-NZ 2.92Å
347	K	98.4	Very high	98.2	Very high	39 Å²	39	48.6 Å²	48.6	17%	0.17	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-44.7	178.9	171.8	-121.8	65.5	-173.7	0	112.1	A333 V334 A337 I342 T343 A344 G345 I349 I350 L351	A333-K347 HydrophobicContact CB-CG 4.5Å; V334-K347 HydrophobicContact CG2-CD 4.36Å; V334-K347 HydrophobicContact CG2-CG 4.39Å; A337-K347 HydrophobicContact CB-CB 3.67Å; A337-K347 HydrophobicContact CB-CD 3.92Å; A337-K347 HydrophobicContact CB-CG 3.85Å; I342-K347 HydrophobicContact CD1-CB 3.9Å; I342-K347 HydrophobicContact CG1-CB 4.41Å; T343-K347 PolarHBondContact O-N 3.42Å; T343-K347 VanDerWaalsContact O-N 3.09Å; A344-K347 WeakPolarHBondContact O-CB 3.46Å; A344-K347 WeakPolarHBondContact O-CE 2.89Å; A344-K347 PolarHBondContact O-N 3.04Å; G345-K347 VanDerWaalsContact C-N 3.28Å; G345-K347 PolarHBondContact O-N 2.93Å; K347-I349 VanDerWaalsContact C-N 3.33Å; K347-I349 PolarHBondContact O-N 3.49Å; K347-I350 PolarHBondContact O-N 3.01Å; K347-L351 HydrophobicContact CD-CD1 4.23Å; K347-L351 HydrophobicContact CG-CD1 4.16Å; K347-L351 VanDerWaalsContact O-CG 3.26Å; K347-L351 WeakPolarHBondContact O-CG 3.35Å; K347-L351 PolarHBondContact O-N 3.26Å
348	D	98.5	Very high	98.1	Very high	86 Å²	86	49.6 Å²	49.6	46%	0.46	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-41.9	177.8	-71.3	-49.9	0	0	0	111.1	A344 G345 L351 E352	A344-D348 PolarHBondContact O-N 3.21Å; G345-D348 PolarHBondContact O-N 3.36Å; D348-L351 PolarHBondContact O-N 3.27Å; D348-E352 PolarHBondContact O-N 3.48Å
349	I	98.5	Very high	98.1	Very high	77 Å²	77	49.6 Å²	49.6	40%	0.395	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-41.3	175.5	-68.6	166.3	0	0	0	111.9	G345 D346 K347 G353 V387 P390	G345-I349 WeakPolarHBondContact O-CB 3.48Å; G345-I349 WeakPolarHBondContact O-CD1 3.47Å; G345-I349 VanDerWaalsContact O-CG1 3.24Å; G345-I349 WeakPolarHBondContact O-CG1 3.41Å; G345-I349 PolarHBondContact O-N 3.48Å; D346-I349 PolarHBondContact O-N 2.93Å; K347-I349 VanDerWaalsContact C-N 3.33Å; K347-I349 PolarHBondContact O-N 3.49Å; I349-G353 PolarHBondContact O-N 2.92Å; I349-V387 HydrophobicContact CG2-CB 3.58Å; I349-V387 HydrophobicContact CG2-CG1 3.91Å; I349-V387 HydrophobicContact CG2-CG2 3.95Å; I349-P390 HydrophobicContact CD1-CG 4.47Å; I349-P390 HydrophobicContact CG2-CB 4.11Å; I349-P390 HydrophobicContact CG2-CG 4.06Å
350	I	98.6	Very high	98.1	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-45.6	175.6	-72.6	160.8	0	0	0	110.9	A333 I342 D346 K347 G353 L354 L383 P390 L394	A333-I350 HydrophobicContact CB-CB 4.43Å; A333-I350 HydrophobicContact CB-CG2 3.73Å; I342-I350 HydrophobicContact CD1-CD1 3.81Å; D346-I350 WeakPolarHBondContact O-CB 3.47Å; D346-I350 WeakPolarHBondContact O-CD1 3.42Å; D346-I350 WeakPolarHBondContact O-CG1 3.28Å; D346-I350 PolarHBondContact O-N 3.16Å; K347-I350 PolarHBondContact O-N 3.01Å; I350-G353 PolarHBondContact O-N 3.06Å; I350-L354 HydrophobicContact CG2-CD1 3.97Å; I350-L354 HydrophobicContact CG2-CG 4.46Å; I350-L354 WeakPolarHBondContact O-CG 3.47Å; I350-L354 PolarHBondContact O-N 3.38Å; I350-L383 HydrophobicContact CG2-CD2 4.32Å; I350-P390 WeakPolarHBondContact CD1-O 3.27Å; I350-P390 HydrophobicContact CG1-CB 4.12Å; I350-L394 HydrophobicContact CG2-CD1 4.26Å; I350-L394 HydrophobicContact CG2-CD2 4.15Å
351	L	98.6	Very high	98	Very high	34 Å²	34	48.5 Å²	48.5	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-47.2	-179.7	-68.4	173.5	0	0	0	111.1	R330 V334 K347 D348 G353 L354 D355	R330-L351 HydrophobicContact CB-CD2 3.75Å; R330-L351 HydrophobicContact CG-CD2 3.68Å; V334-L351 HydrophobicContact CG2-CD1 4.09Å; V334-L351 HydrophobicContact CG2-CD2 4.43Å; K347-L351 HydrophobicContact CD-CD1 4.23Å; K347-L351 HydrophobicContact CG-CD1 4.16Å; K347-L351 VanDerWaalsContact O-CG 3.26Å; K347-L351 WeakPolarHBondContact O-CG 3.35Å; K347-L351 PolarHBondContact O-N 3.26Å; D348-L351 PolarHBondContact O-N 3.27Å; L351-G353 VanDerWaalsContact C-N 3.29Å; L351-G353 PolarHBondContact O-N 3.15Å; L351-L354 PolarHBondContact O-N 3.12Å; L351-D355 VanDerWaalsContact O-CG 3.24Å; L351-D355 PolarHBondContact O-N 2.89Å
352	E	98.5	Very high	97.9	Very high	117 Å²	117	51.8 Å²	51.8	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-39.7	175.4	-159.9	-158.6	143.1	0	0	111.6	D348 L354 D355 Q356	D348-E352 PolarHBondContact O-N 3.48Å; E352-L354 PolarHBondContact O-N 2.92Å; E352-D355 PolarHBondContact O-N 3.25Å; E352-Q356 VanDerWaalsContact O-CG 3.3Å; E352-Q356 WeakPolarHBondContact O-CG 3.39Å; E352-Q356 PolarHBondContact O-N 3.25Å; E352-Q356 PolarHBondContact OE1-NE2 3.43Å
353	G	98.5	Very high	97.8	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-43.2	174.8	0	0	0	0	0	113.1	I349 I350 L351 I357 K386	I349-G353 PolarHBondContact O-N 2.92Å; I350-G353 PolarHBondContact O-N 3.06Å; L351-G353 VanDerWaalsContact C-N 3.29Å; L351-G353 PolarHBondContact O-N 3.15Å; G353-I357 WeakPolarHBondContact O-CD1 3.32Å; G353-I357 VanDerWaalsContact O-CG1 3.3Å; G353-I357 WeakPolarHBondContact O-CG1 3.47Å; G353-I357 PolarHBondContact O-N 3.09Å; G353-I357 VanDerWaalsContact O-N 3.16Å; G353-K386 WeakPolarHBondContact O-CD 3.48Å
354	L	98.5	Very high	97.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68.1	-42.6	176.2	-73.8	172.9	0	0	0	112.2	I326 R330 I350 L351 E352 Q356 I357 E358 I379 L383	I326-L354 HydrophobicContact CG2-CB 4.16Å; I326-L354 HydrophobicContact CG2-CD2 4.35Å; R330-L354 HydrophobicContact CG-CB 4.47Å; R330-L354 HydrophobicContact CG-CD1 3.85Å; I350-L354 HydrophobicContact CG2-CD1 3.97Å; I350-L354 HydrophobicContact CG2-CG 4.46Å; I350-L354 WeakPolarHBondContact O-CG 3.47Å; I350-L354 PolarHBondContact O-N 3.38Å; L351-L354 PolarHBondContact O-N 3.12Å; E352-L354 PolarHBondContact O-N 2.92Å; L354-Q356 VanDerWaalsContact C-N 3.31Å; L354-Q356 PolarHBondContact O-N 3.14Å; L354-I357 PolarHBondContact O-N 3.37Å; L354-E358 PolarHBondContact O-N 3.41Å; L354-I379 HydrophobicContact CD2-CG2 4.09Å; L354-L383 HydrophobicContact CD2-CD1 4.21Å; L354-L383 HydrophobicContact CD2-CD2 4.16Å; L354-L383 HydrophobicContact CG-CD1 4.08Å; L354-L383 HydrophobicContact CG-CD2 4.34Å
355	D	98.4	Very high	97.5	Very high	82 Å²	82	58 Å²	58	44%	0.439	31%	0.308	S	S	.	.	H	α-helix	trans	-60.6	-40.4	176.3	-67.8	1.7	0	0	0	111.7	R330 L351 E352 I357 K359	R330-D355 IonicContact CZ-OD1 3.32Å; R330-D355 IonicContact NE-OD1 3.64Å; R330-D355 PolarHBondContact NE-OD1 2.92Å; R330-D355 IonicContact NH2-OD1 2.74Å; R330-D355 PolarHBondContact NH2-OD1 2.95Å; L351-D355 VanDerWaalsContact O-CG 3.24Å; L351-D355 PolarHBondContact O-N 2.89Å; E352-D355 PolarHBondContact O-N 3.25Å; D355-I357 VanDerWaalsContact C-N 3.33Å; D355-I357 PolarHBondContact O-N 2.93Å; D355-K359 WeakPolarHBondContact O-CB 3.3Å; D355-K359 PolarHBondContact O-N 3.31Å; D355-K359 VanDerWaalsContact O-N 3.12Å
356	Q	98.1	Very high	97.3	Very high	76 Å²	76	57.5 Å²	57.5	36%	0.355	30%	0.295	S	S	.	.	H	α-helix	trans	-68.2	-29	173.7	-69.7	-177.2	31.3	0	0	113.1	E352 L354 L360 K386	E352-Q356 VanDerWaalsContact O-CG 3.3Å; E352-Q356 WeakPolarHBondContact O-CG 3.39Å; E352-Q356 PolarHBondContact O-N 3.25Å; E352-Q356 PolarHBondContact OE1-NE2 3.43Å; L354-Q356 VanDerWaalsContact C-N 3.31Å; L354-Q356 PolarHBondContact O-N 3.14Å; Q356-L360 VanDerWaalsContact O-CG 3.32Å; Q356-L360 WeakPolarHBondContact O-CG 3.5Å; Q356-L360 PolarHBondContact O-N 3.2Å; Q356-K386 HydrophobicContact CB-CD 3.86Å
357	I	97.8	Very high	96.9	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-77.1	-48	177.3	-73.9	164.5	0	0	0	111	I326 G353 L354 D355 K359 L360 I361 F366 A382 L383 K386	I326-I357 HydrophobicContact CD1-CG2 3.97Å; G353-I357 WeakPolarHBondContact O-CD1 3.32Å; G353-I357 VanDerWaalsContact O-CG1 3.3Å; G353-I357 WeakPolarHBondContact O-CG1 3.47Å; G353-I357 PolarHBondContact O-N 3.09Å; G353-I357 VanDerWaalsContact O-N 3.16Å; L354-I357 PolarHBondContact O-N 3.37Å; D355-I357 VanDerWaalsContact C-N 3.33Å; D355-I357 PolarHBondContact O-N 2.93Å; I357-K359 VanDerWaalsContact C-N 3.25Å; I357-K359 PolarHBondContact O-N 2.91Å; I357-L360 WeakPolarHBondContact O-CB 3.44Å; I357-L360 PolarHBondContact O-N 3.18Å; I357-I361 HydrophobicContact CG2-CD1 3.96Å; I357-I361 WeakPolarHBondContact O-CG1 3.48Å; I357-I361 PolarHBondContact O-N 3.1Å; I357-F366 HydrophobicContact CG2-CD2 4.08Å; I357-F366 HydrophobicContact CG2-CE2 3.71Å; I357-A382 HydrophobicContact CD1-CB 3.96Å; I357-A382 HydrophobicContact CG1-CB 4.33Å; I357-L383 HydrophobicContact CD1-CB 3.83Å; I357-L383 HydrophobicContact CD1-CD1 3.97Å; I357-K386 HydrophobicContact CG1-CD 4.39Å
358	E	97.7	Very high	96.6	Very high	42 Å²	42	65.3 Å²	65.3	20%	0.196	33%	0.329	C	S	.	.	H	α-helix	trans	-52.1	-47.3	173.1	164	158.6	-159.7	0	0	110.8	W322 I326 R330 L354 L360 I361 Q362	W322-E358 HydrophobicContact CH2-CG 3.83Å; W322-E358 HydrophobicContact CZ3-CB 3.94Å; W322-E358 HydrophobicContact CZ3-CG 3.62Å; I326-E358 HydrophobicContact CD1-CB 3.91Å; R330-E358 IonicContact CZ-OE2 2.69Å; R330-E358 IonicContact NH1-OE2 3.72Å; R330-E358 PolarHBondContact NH1-OE2 2.95Å; R330-E358 IonicContact NH2-OE2 3.8Å; R330-E358 PolarHBondContact NH2-OE2 2.79Å; L354-E358 PolarHBondContact O-N 3.41Å; E358-L360 VanDerWaalsContact C-N 3.32Å; E358-L360 PolarHBondContact O-N 3.48Å; E358-I361 PolarHBondContact O-N 3.43Å; E358-I361 VanDerWaalsContact O-N 3.12Å; E358-Q362 HydrophobicContact CG-CG 4.28Å; E358-Q362 WeakPolarHBondContact O-CG 3.49Å; E358-Q362 PolarHBondContact O-N 3.42Å; E358-Q362 PolarHBondContact OE1-NE2 2.9Å
359	K	97.5	Very high	96.1	Very high	129 Å²	129	64.2 Å²	64.2	56%	0.561	32%	0.319	S	S	*	.	H	α-helix	trans	-61.5	-37.1	177.4	-174.1	171.3	-177.3	173.9	0	113.2	D355 I357 I361 D363	D355-K359 WeakPolarHBondContact O-CB 3.3Å; D355-K359 PolarHBondContact O-N 3.31Å; D355-K359 VanDerWaalsContact O-N 3.12Å; I357-K359 VanDerWaalsContact C-N 3.25Å; I357-K359 PolarHBondContact O-N 2.91Å; K359-I361 VanDerWaalsContact C-N 3.34Å; K359-D363 WeakPolarHBondContact O-CB 3.38Å; K359-D363 PolarHBondContact O-N 2.73Å
360	L	97	Very high	95.3	Very high	60 Å²	60	67.1 Å²	67.1	31%	0.314	34%	0.34	S	S	.	.	H	α-helix	trans	-67.6	-34.9	175.7	-76.7	167.6	0	0	0	112.1	Q356 I357 E358 G364 K365 F366	Q356-L360 VanDerWaalsContact O-CG 3.32Å; Q356-L360 WeakPolarHBondContact O-CG 3.5Å; Q356-L360 PolarHBondContact O-N 3.2Å; I357-L360 WeakPolarHBondContact O-CB 3.44Å; I357-L360 PolarHBondContact O-N 3.18Å; E358-L360 VanDerWaalsContact C-N 3.32Å; E358-L360 PolarHBondContact O-N 3.48Å; L360-G364 PolarHBondContact O-N 2.94Å; L360-K365 HydrophobicContact CD2-CB 3.89Å; L360-K365 CarbonylContact O-C 3.56Å; L360-K365 WeakPolarHBondContact O-CA 3.44Å; L360-K365 PolarHBondContact O-N 2.97Å; L360-F366 HydrophobicContact CB-CB 4.17Å; L360-F366 HydrophobicContact CB-CD2 4.31Å; L360-F366 PolarHBondContact O-N 3.17Å
361	I	95.5	Very high	94.5	Very high	20 Å²	20	70.9 Å²	70.9	10%	0.103	36%	0.36	C	S	.	.	H	α-helix	trans	-69.8	-50.6	176.2	-61.7	163.6	0	0	0	109.7	W322 I326 I357 E358 K359 D363 G364 F366 W368	W322-I361 HydrophobicContact CB-CD1 4.23Å; W322-I361 HydrophobicContact CD2-CB 4.28Å; W322-I361 HydrophobicContact CD2-CD1 4.04Å; W322-I361 HydrophobicContact CD2-CG2 3.6Å; W322-I361 HydrophobicContact CE3-CB 4.31Å; W322-I361 HydrophobicContact CE3-CD1 3.72Å; W322-I361 HydrophobicContact CE3-CG2 4.12Å; W322-I361 HydrophobicContact CG-CD1 4.28Å; W322-I361 HydrophobicContact CG-CG2 3.84Å; W322-I361 HydrophobicContact CZ2-CG2 4.23Å; I326-I361 HydrophobicContact CD1-CD1 4.03Å; I357-I361 HydrophobicContact CG2-CD1 3.96Å; I357-I361 WeakPolarHBondContact O-CG1 3.48Å; I357-I361 PolarHBondContact O-N 3.1Å; E358-I361 PolarHBondContact O-N 3.43Å; E358-I361 VanDerWaalsContact O-N 3.12Å; K359-I361 VanDerWaalsContact C-N 3.34Å; I361-D363 VanDerWaalsContact C-N 3.3Å; I361-D363 PolarHBondContact O-N 3.41Å; I361-G364 PolarHBondContact O-N 2.84Å; I361-F366 HydrophobicContact CB-CB 4.29Å; I361-F366 HydrophobicContact CD1-CD2 4.41Å; I361-F366 HydrophobicContact CD1-CG 4.41Å; I361-F366 HydrophobicContact CG1-CB 3.55Å; I361-F366 HydrophobicContact CG1-CD1 4.14Å; I361-F366 HydrophobicContact CG1-CD2 3.84Å; I361-F366 HydrophobicContact CG1-CG 3.57Å; I361-W368 HydrophobicContact CD1-CH2 3.88Å; I361-W368 HydrophobicContact CD1-CZ2 3.8Å; I361-W368 HydrophobicContact CG1-CH2 4.37Å; I361-W368 HydrophobicContact CG1-CZ2 3.84Å; I361-W368 HydrophobicContact CG2-CZ2 3.99Å
362	Q	95.1	Very high	93.7	Very high	121 Å²	121	70.6 Å²	70.6	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-58.2	-37.8	176.5	-69.9	174.6	-6.6	0	0	113.1	W322 E358 G364	W322-Q362 HydrophobicContact CH2-CG 3.85Å; W322-Q362 HydrophobicContact CZ2-CG 4.14Å; E358-Q362 HydrophobicContact CG-CG 4.28Å; E358-Q362 WeakPolarHBondContact O-CG 3.49Å; E358-Q362 PolarHBondContact O-N 3.42Å; E358-Q362 PolarHBondContact OE1-NE2 2.9Å; Q362-G364 PolarHBondContact O-N 2.85Å
363	D	96.1	Very high	92.6	Very high	77 Å²	77	66.2 Å²	66.2	41%	0.412	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-6.6	176	-90.9	-7.3	0	0	0	113.7	K359 I361 K365	K359-D363 WeakPolarHBondContact O-CB 3.38Å; K359-D363 PolarHBondContact O-N 2.73Å; I361-D363 VanDerWaalsContact C-N 3.3Å; I361-D363 PolarHBondContact O-N 3.41Å; D363-K365 VanDerWaalsContact C-N 3.33Å; D363-K365 HydrophobicContact CB-CB 4.34Å; D363-K365 HydrophobicContact CB-CD 3.68Å; D363-K365 HydrophobicContact CB-CG 3.98Å; D363-K365 IonicContact OD1-NZ 3.66Å; D363-K365 IonicContact OD2-NZ 2.76Å; D363-K365 PolarHBondContact OD2-NZ 3.4Å
364	G	94	Very high	92	Very high	70 Å²	70	67 Å²	67	72%	0.722	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	26.6	-173.5	0	0	0	0	0	114.1	L360 I361 Q362	L360-G364 PolarHBondContact O-N 2.94Å; I361-G364 PolarHBondContact O-N 2.84Å; Q362-G364 PolarHBondContact O-N 2.85Å
365	K	95.6	Very high	91.7	Very high	136 Å²	136	67 Å²	67	59%	0.591	34%	0.34	S	S	*	.			trans	-114.5	-5.1	-172.8	-66.4	169.5	-160.7	156.5	0	114.1	L360 D363	L360-K365 HydrophobicContact CD2-CB 3.89Å; L360-K365 CarbonylContact O-C 3.56Å; L360-K365 WeakPolarHBondContact O-CA 3.44Å; L360-K365 PolarHBondContact O-N 2.97Å; D363-K365 VanDerWaalsContact C-N 3.33Å; D363-K365 HydrophobicContact CB-CB 4.34Å; D363-K365 HydrophobicContact CB-CD 3.68Å; D363-K365 HydrophobicContact CB-CG 3.98Å; D363-K365 IonicContact OD1-NZ 3.66Å; D363-K365 IonicContact OD2-NZ 2.76Å; D363-K365 PolarHBondContact OD2-NZ 3.4Å
366	F	93.9	Very high	91.5	Very high	26 Å²	26	63.1 Å²	63.1	11%	0.114	32%	0.32	C	S	.	.			trans	-75.4	128.4	177	-170.8	-87.7	0	0	0	110.8	I357 L360 I361 W368 N378 A382	I357-F366 HydrophobicContact CG2-CD2 4.08Å; I357-F366 HydrophobicContact CG2-CE2 3.71Å; L360-F366 HydrophobicContact CB-CB 4.17Å; L360-F366 HydrophobicContact CB-CD2 4.31Å; L360-F366 PolarHBondContact O-N 3.17Å; I361-F366 HydrophobicContact CB-CB 4.29Å; I361-F366 HydrophobicContact CD1-CD2 4.41Å; I361-F366 HydrophobicContact CD1-CG 4.41Å; I361-F366 HydrophobicContact CG1-CB 3.55Å; I361-F366 HydrophobicContact CG1-CD1 4.14Å; I361-F366 HydrophobicContact CG1-CD2 3.84Å; I361-F366 HydrophobicContact CG1-CG 3.57Å; F366-W368 AromaticContact CD1-CD2 3.62Å; F366-W368 HydrophobicContact CD1-CD2 3.62Å; F366-W368 AromaticContact CD1-CE2 3.63Å; F366-W368 AromaticContact CD1-CE3 3.93Å; F366-W368 HydrophobicContact CD1-CE3 3.93Å; F366-W368 HydrophobicContact CD1-CG 4.07Å; F366-W368 HydrophobicContact CD1-CH2 4.19Å; F366-W368 AromaticContact CD1-CZ2 3.93Å; F366-W368 HydrophobicContact CD1-CZ2 3.93Å; F366-W368 HydrophobicContact CD1-CZ3 4.2Å; F366-W368 AromaticContact CE1-CD2 3.77Å; F366-W368 HydrophobicContact CE1-CD2 3.77Å; F366-W368 AromaticContact CE1-CE3 3.56Å; F366-W368 HydrophobicContact CE1-CE3 3.56Å; F366-W368 HydrophobicContact CE1-CG 4.45Å; F366-W368 HydrophobicContact CE1-CH2 4.03Å; F366-W368 HydrophobicContact CE1-CZ2 4.24Å; F366-W368 AromaticContact CE1-CZ3 3.7Å; F366-W368 HydrophobicContact CE1-CZ3 3.7Å; F366-W368 HydrophobicContact CZ-CZ3 4.49Å; F366-W368 PolarHBondContact O-N 3.35Å; F366-N378 HydrophobicContact CE1-CB 4.14Å; F366-N378 HydrophobicContact CZ-CB 4.34Å; F366-A382 HydrophobicContact CE2-CB 3.53Å; F366-A382 HydrophobicContact CZ-CB 3.73Å
367	E	91.1	Very high	91.1	Very high	154 Å²	154	60.6 Å²	60.6	72%	0.72	31%	0.308	S	S	*	.			trans	-85	98.9	177.4	-170.7	-178.6	152.8	0	0	110.1	R369	E367-R369 HydrophobicContact CG-CG 4.41Å; E367-R369 PolarHBondContact O-N 3.45Å; E367-R369 VanDerWaalsContact O-N 3.15Å
368	W	90.5	Very high	91	Very high	63 Å²	63	60.8 Å²	60.8	24%	0.239	31%	0.309	C	S	.	.			trans	-69.3	107.1	171.6	-66.1	111.1	0	0	0	110.3	A318 W322 I361 F366 V375 N378 I379	A318-W368 HydrophobicContact CB-CD2 3.65Å; A318-W368 HydrophobicContact CB-CE3 3.67Å; A318-W368 HydrophobicContact CB-CG 4.38Å; A318-W368 HydrophobicContact CB-CH2 3.8Å; A318-W368 HydrophobicContact CB-CZ2 3.74Å; A318-W368 HydrophobicContact CB-CZ3 3.75Å; W322-W368 HydrophobicContact CB-CH2 3.82Å; W322-W368 HydrophobicContact CB-CZ2 4.07Å; I361-W368 HydrophobicContact CD1-CH2 3.88Å; I361-W368 HydrophobicContact CD1-CZ2 3.8Å; I361-W368 HydrophobicContact CG1-CH2 4.37Å; I361-W368 HydrophobicContact CG1-CZ2 3.84Å; I361-W368 HydrophobicContact CG2-CZ2 3.99Å; F366-W368 AromaticContact CD1-CD2 3.62Å; F366-W368 HydrophobicContact CD1-CD2 3.62Å; F366-W368 AromaticContact CD1-CE2 3.63Å; F366-W368 AromaticContact CD1-CE3 3.93Å; F366-W368 HydrophobicContact CD1-CE3 3.93Å; F366-W368 HydrophobicContact CD1-CG 4.07Å; F366-W368 HydrophobicContact CD1-CH2 4.19Å; F366-W368 AromaticContact CD1-CZ2 3.93Å; F366-W368 HydrophobicContact CD1-CZ2 3.93Å; F366-W368 HydrophobicContact CD1-CZ3 4.2Å; F366-W368 AromaticContact CE1-CD2 3.77Å; F366-W368 HydrophobicContact CE1-CD2 3.77Å; F366-W368 AromaticContact CE1-CE3 3.56Å; F366-W368 HydrophobicContact CE1-CE3 3.56Å; F366-W368 HydrophobicContact CE1-CG 4.45Å; F366-W368 HydrophobicContact CE1-CH2 4.03Å; F366-W368 HydrophobicContact CE1-CZ2 4.24Å; F366-W368 AromaticContact CE1-CZ3 3.7Å; F366-W368 HydrophobicContact CE1-CZ3 3.7Å; F366-W368 HydrophobicContact CZ-CZ3 4.49Å; F366-W368 PolarHBondContact O-N 3.35Å; W368-V375 HydrophobicContact CH2-CG2 3.89Å; W368-V375 HydrophobicContact CZ3-CG2 3.87Å; W368-N378 HydrophobicContact CE3-CB 3.66Å; W368-N378 HydrophobicContact CZ3-CB 3.61Å; W368-I379 HydrophobicContact CH2-CD1 4.49Å; W368-I379 HydrophobicContact CH2-CG1 4.4Å
369	R	87.8	Confident	90.9	Very high	64 Å²	64	58.9 Å²	58.9	24%	0.242	30%	0.301	C	S	.	.			trans	-87.8	121.8	-172.1	-73.4	172.9	62.2	161	5.2	111.6	E367 D371 R372 N378 E385	E367-R369 HydrophobicContact CG-CG 4.41Å; E367-R369 PolarHBondContact O-N 3.45Å; E367-R369 VanDerWaalsContact O-N 3.15Å; R369-D371 WeakPolarHBondContact CB-OD1 3.4Å; R369-D371 IonicContact CZ-OD1 3.3Å; R369-D371 IonicContact CZ-OD2 2.99Å; R369-D371 IonicContact NE-OD1 2.74Å; R369-D371 PolarHBondContact NE-OD1 3.49Å; R369-D371 IonicContact NH2-OD1 2.9Å; R369-D371 PolarHBondContact NH2-OD1 3.14Å; R369-D371 VanDerWaalsContact NH2-OD1 3.08Å; R369-D371 IonicContact NH2-OD2 3.21Å; R369-D371 PolarHBondContact NH2-OD2 2.93Å; R369-D371 PolarHBondContact O-N 2.85Å; R369-R372 HydrophobicContact CB-CB 4.46Å; R369-R372 HydrophobicContact CB-CG 4.02Å; R369-R372 VanDerWaalsContact CZ-NH2 3.33Å; R369-R372 WeakPolarHBondContact O-CB 3.48Å; R369-R372 PolarHBondContact O-N 3.06Å; R369-R372 VanDerWaalsContact O-N 3.07Å; R369-N378 WeakPolarHBondContact CB-OD1 3.27Å; R369-N378 PolarHBondContact N-OD1 2.83Å; R369-N378 PolarHBondContact O-OD1 2.89Å; R369-E385 IonicContact NH1-OE1 3Å; R369-E385 PolarHBondContact NH1-OE1 3.1Å; R369-E385 IonicContact NH1-OE2 2.82Å
370	T	82	Confident	90.8	Very high	138 Å²	138	54.6 Å²	54.6	85%	0.847	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-1.1	174.5	54.8	0	0	0	0	114	R372	T370-R372 VanDerWaalsContact C-N 3.34Å
371	D	82.3	Confident	90.7	Very high	78 Å²	78	52.4 Å²	52.4	42%	0.417	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.1	164.6	84.1	-56.7	0	0	0	113.3	R369	R369-D371 WeakPolarHBondContact CB-OD1 3.4Å; R369-D371 IonicContact CZ-OD1 3.3Å; R369-D371 IonicContact CZ-OD2 2.99Å; R369-D371 IonicContact NE-OD1 2.74Å; R369-D371 PolarHBondContact NE-OD1 3.49Å; R369-D371 IonicContact NH2-OD1 2.9Å; R369-D371 PolarHBondContact NH2-OD1 3.14Å; R369-D371 VanDerWaalsContact NH2-OD1 3.08Å; R369-D371 IonicContact NH2-OD2 3.21Å; R369-D371 PolarHBondContact NH2-OD2 2.93Å; R369-D371 PolarHBondContact O-N 2.85Å
372	R	82	Confident	90.8	Very high	29 Å²	29	52.5 Å²	52.5	11%	0.109	28%	0.277	C	S	.	.	S	Bend	trans	-110	147	166.8	-64.1	-67.2	168.2	-81.3	-5.1	108.9	R369 T370 M377 N378 A381	R369-R372 HydrophobicContact CB-CB 4.46Å; R369-R372 HydrophobicContact CB-CG 4.02Å; R369-R372 VanDerWaalsContact CZ-NH2 3.33Å; R369-R372 WeakPolarHBondContact O-CB 3.48Å; R369-R372 PolarHBondContact O-N 3.06Å; R369-R372 VanDerWaalsContact O-N 3.07Å; T370-R372 VanDerWaalsContact C-N 3.34Å; R372-M377 HydrophobicContact CB-CB 3.94Å; R372-M377 WeakPolarHBondContact CD-O 3.46Å; R372-M377 HydrophobicContact CG-CB 4.47Å; R372-N378 WeakPolarHBondContact CB-ND2 3.32Å; R372-A381 VanDerWaalsContact NE-CB 3.32Å
373	E	75.7	Confident	90.9	Very high	25 Å²	25	46.8 Å²	46.8	12%	0.117	25%	0.25	C	S	.	.	S	Bend	trans	-78.5	-51.8	-169.6	-170.5	169.6	172.1	0	0	112	W295 P312 M377 R610	W295-E373 WeakPolarHBondContact CB-OE2 3.38Å; P312-E373 WeakPolarHBondContact CD-O 3.38Å; P312-E373 WeakPolarHBondContact CG-O 3.4Å; E373-M377 HydrophobicContact CB-CG 4.29Å; E373-M377 HydrophobicContact CB-SD 3.65Å; E373-R610 IonicContact OE1-CZ 2.83Å; E373-R610 IonicContact OE1-NH1 3.39Å; E373-R610 PolarHBondContact OE1-NH1 3.28Å; E373-R610 IonicContact OE1-NH2 3.08Å; E373-R610 PolarHBondContact OE1-NH2 3.01Å
374	D	85.9	Confident	91	Very high	15 Å²	15	45.9 Å²	45.9	8%	0.08	24%	0.244	C	C	.	.	S	Bend	trans	-128.6	173.5	-174.5	49.1	35.5	0	0	0	111.9	H376 M377 N378 R400	D374-H376 PolarHBondContact O-N 3.26Å; D374-H376 IonicContact OD1-ND1 2.71Å; D374-M377 PolarHBondContact O-N 3.41Å; D374-M377 WeakPolarHBondContact OD1-CA 3.39Å; D374-M377 WeakPolarHBondContact OD1-CB 3.34Å; D374-M377 WeakPolarHBondContact OD1-CG 3.38Å; D374-M377 PolarHBondContact OD1-N 3.04Å; D374-N378 PolarHBondContact O-N 2.91Å; D374-N378 PolarHBondContact O-ND2 3.49Å; D374-R400 VanDerWaalsContact CG-NE 3.34Å; D374-R400 IonicContact OD1-CZ 2.91Å; D374-R400 IonicContact OD1-NE 3.14Å; D374-R400 PolarHBondContact OD1-NE 3.26Å; D374-R400 IonicContact OD1-NH2 3.73Å; D374-R400 PolarHBondContact OD1-NH2 3.07Å; D374-R400 IonicContact OD2-CZ 2.74Å; D374-R400 IonicContact OD2-NE 3.85Å; D374-R400 PolarHBondContact OD2-NE 2.9Å; D374-R400 IonicContact OD2-NH2 3.81Å; D374-R400 PolarHBondContact OD2-NH2 2.85Å
375	V	91.6	Very high	91.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-53.9	-40	175	59.4	0	0	0	0	111.3	E317 A318 L321 W322 W368 N378 I379	E317-V375 HydrophobicContact CG-CG1 4.27Å; A318-V375 HydrophobicContact CB-CG2 4.23Å; L321-V375 HydrophobicContact CB-CG1 4.18Å; W322-V375 HydrophobicContact CB-CG2 3.98Å; W368-V375 HydrophobicContact CH2-CG2 3.89Å; W368-V375 HydrophobicContact CZ3-CG2 3.87Å; V375-N378 WeakPolarHBondContact O-CB 3.39Å; V375-N378 PolarHBondContact O-N 3.22Å; V375-I379 HydrophobicContact CG2-CD1 3.93Å; V375-I379 WeakPolarHBondContact O-CG1 3.35Å; V375-I379 PolarHBondContact O-N 2.8Å; V375-I379 VanDerWaalsContact O-N 3.07Å
376	H	93.6	Very high	91.2	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-40.7	-179.5	-38.2	81.3	0	0	0	112.5	D325 D374 N378 I379 E380 Q403 D407	D325-H376 VanDerWaalsContact CG-CD2 3.46Å; D325-H376 IonicContact OD1-CD2 3.57Å; D325-H376 WeakPolarHBondContact OD2-CA 3.41Å; D325-H376 IonicContact OD2-CD2 2.73Å; D374-H376 PolarHBondContact O-N 3.26Å; D374-H376 IonicContact OD1-ND1 2.71Å; H376-N378 PolarHBondContact O-N 3.07Å; H376-I379 PolarHBondContact O-N 3.17Å; H376-E380 WeakPolarHBondContact O-CB 3.46Å; H376-E380 PolarHBondContact O-N 3.1Å; H376-Q403 VanDerWaalsContact CD2-CD 3.5Å; H376-Q403 PolarHBondContact CD2-NE2 3.04Å; H376-D407 IonicContact CD2-OD2 3.43Å; H376-D407 PolarHBondContact CD2-OD2 2.93Å; H376-D407 IonicContact CE1-OD2 3.19Å; H376-D407 IonicContact NE2-OD2 2.85Å; H376-D407 PolarHBondContact NE2-OD2 3.11Å
377	M	91.6	Very high	91.3	Very high	23 Å²	23	46.6 Å²	46.6	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-31.7	175.8	-84.9	-148.5	92.7	0	0	111	R372 E373 D374 A381	R372-M377 HydrophobicContact CB-CB 3.94Å; R372-M377 WeakPolarHBondContact CD-O 3.46Å; R372-M377 HydrophobicContact CG-CB 4.47Å; E373-M377 HydrophobicContact CB-CG 4.29Å; E373-M377 HydrophobicContact CB-SD 3.65Å; D374-M377 PolarHBondContact O-N 3.41Å; D374-M377 WeakPolarHBondContact OD1-CA 3.39Å; D374-M377 WeakPolarHBondContact OD1-CB 3.34Å; D374-M377 WeakPolarHBondContact OD1-CG 3.38Å; D374-M377 PolarHBondContact OD1-N 3.04Å; M377-A381 WeakPolarHBondContact O-CB 3.45Å; M377-A381 PolarHBondContact O-N 2.92Å
378	N	93.8	Very high	91.6	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-67.8	-51.3	173.2	-81.1	-82.5	0	0	0	111.1	F366 W368 R369 R372 D374 V375 H376 A381 A382	F366-N378 HydrophobicContact CE1-CB 4.14Å; F366-N378 HydrophobicContact CZ-CB 4.34Å; W368-N378 HydrophobicContact CE3-CB 3.66Å; W368-N378 HydrophobicContact CZ3-CB 3.61Å; R369-N378 WeakPolarHBondContact CB-OD1 3.27Å; R369-N378 PolarHBondContact N-OD1 2.83Å; R369-N378 PolarHBondContact O-OD1 2.89Å; R372-N378 WeakPolarHBondContact CB-ND2 3.32Å; D374-N378 PolarHBondContact O-N 2.91Å; D374-N378 PolarHBondContact O-ND2 3.49Å; V375-N378 WeakPolarHBondContact O-CB 3.39Å; V375-N378 PolarHBondContact O-N 3.22Å; H376-N378 PolarHBondContact O-N 3.07Å; N378-A381 PolarHBondContact O-N 3.48Å; N378-A382 WeakPolarHBondContact O-CB 3.2Å; N378-A382 PolarHBondContact O-N 3.15Å
379	I	95.8	Very high	91.9	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-45.9	179.1	-68.3	162	0	0	0	111.1	W322 D325 I326 L354 W368 V375 H376 A382 L383	W322-I379 HydrophobicContact CB-CD1 4.42Å; D325-I379 HydrophobicContact CB-CD1 4.11Å; D325-I379 VanDerWaalsContact OD2-CD1 3.32Å; D325-I379 WeakPolarHBondContact OD2-CD1 3.29Å; I326-I379 HydrophobicContact CD1-CD1 4.43Å; I326-I379 HydrophobicContact CG1-CD1 3.95Å; I326-I379 HydrophobicContact CG1-CG1 4.5Å; I326-I379 HydrophobicContact CG1-CG2 4.17Å; L354-I379 HydrophobicContact CD2-CG2 4.09Å; W368-I379 HydrophobicContact CH2-CD1 4.49Å; W368-I379 HydrophobicContact CH2-CG1 4.4Å; V375-I379 HydrophobicContact CG2-CD1 3.93Å; V375-I379 WeakPolarHBondContact O-CG1 3.35Å; V375-I379 PolarHBondContact O-N 2.8Å; V375-I379 VanDerWaalsContact O-N 3.07Å; H376-I379 PolarHBondContact O-N 3.17Å; I379-A382 PolarHBondContact O-N 3.3Å; I379-L383 VanDerWaalsContact O-CB 3.28Å; I379-L383 WeakPolarHBondContact O-CB 3.35Å; I379-L383 PolarHBondContact O-N 2.66Å
380	E	95.9	Very high	92.3	Very high	38 Å²	38	41 Å²	41	18%	0.178	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-43.6	178	-176.2	166.8	-159.2	0	0	111.7	H376 L383 I384 H395 R400	H376-E380 WeakPolarHBondContact O-CB 3.46Å; H376-E380 PolarHBondContact O-N 3.1Å; E380-L383 PolarHBondContact O-N 3.35Å; E380-I384 HydrophobicContact CG-CD1 4.19Å; E380-I384 WeakPolarHBondContact O-CD1 3.39Å; E380-I384 VanDerWaalsContact O-CG1 3.26Å; E380-I384 WeakPolarHBondContact O-CG1 3.4Å; E380-I384 PolarHBondContact O-N 2.92Å; E380-H395 IonicContact OE1-CE1 2.63Å; E380-H395 IonicContact OE1-CG 2.87Å; E380-H395 IonicContact OE1-ND1 2.94Å; E380-H395 PolarHBondContact OE1-ND1 3.4Å; E380-H395 IonicContact OE2-CE1 3.85Å; E380-H395 IonicContact OE2-ND1 2.75Å; E380-R400 IonicContact OE2-NH1 3.75Å; E380-R400 IonicContact OE2-NH2 2.8Å
381	A	95.3	Very high	93.1	Very high	15 Å²	15	34.6 Å²	34.6	12%	0.124	18%	0.182	C	C	.	.	H	α-helix	trans	-66.6	-45.2	175.3	0	0	0	0	0	112.2	R372 M377 N378 L383 I384 E385	R372-A381 VanDerWaalsContact NE-CB 3.32Å; M377-A381 WeakPolarHBondContact O-CB 3.45Å; M377-A381 PolarHBondContact O-N 2.92Å; N378-A381 PolarHBondContact O-N 3.48Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 3.37Å; A381-I384 PolarHBondContact O-N 3.11Å; A381-E385 WeakPolarHBondContact O-CB 3.5Å; A381-E385 VanDerWaalsContact O-CG 3.32Å; A381-E385 WeakPolarHBondContact O-CG 3.09Å; A381-E385 PolarHBondContact O-N 3.25Å
382	A	96.4	Very high	93.7	Very high	21 Å²	21	36 Å²	36	17%	0.174	18%	0.184	C	C	.	.	H	α-helix	trans	-63.3	-34.3	177.3	0	0	0	0	0	112.3	I357 F366 N378 I379 K386	I357-A382 HydrophobicContact CD1-CB 3.96Å; I357-A382 HydrophobicContact CG1-CB 4.33Å; F366-A382 HydrophobicContact CE2-CB 3.53Å; F366-A382 HydrophobicContact CZ-CB 3.73Å; N378-A382 WeakPolarHBondContact O-CB 3.2Å; N378-A382 PolarHBondContact O-N 3.15Å; I379-A382 PolarHBondContact O-N 3.3Å; A382-K386 WeakPolarHBondContact O-CB 3.39Å; A382-K386 PolarHBondContact O-N 3.36Å
383	L	98	Very high	94.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-69.1	-43.3	175.2	-169.6	69.8	0	0	0	111.3	I350 L354 I357 I379 E380 A381 K386 V387 A391 L394	I350-L383 HydrophobicContact CG2-CD2 4.32Å; L354-L383 HydrophobicContact CD2-CD1 4.21Å; L354-L383 HydrophobicContact CD2-CD2 4.16Å; L354-L383 HydrophobicContact CG-CD1 4.08Å; L354-L383 HydrophobicContact CG-CD2 4.34Å; I357-L383 HydrophobicContact CD1-CB 3.83Å; I357-L383 HydrophobicContact CD1-CD1 3.97Å; I379-L383 VanDerWaalsContact O-CB 3.28Å; I379-L383 WeakPolarHBondContact O-CB 3.35Å; I379-L383 PolarHBondContact O-N 2.66Å; E380-L383 PolarHBondContact O-N 3.35Å; A381-L383 VanDerWaalsContact C-N 3.28Å; A381-L383 PolarHBondContact O-N 3.37Å; L383-K386 PolarHBondContact O-N 2.74Å; L383-V387 HydrophobicContact CD1-CG2 4.28Å; L383-V387 HydrophobicContact CG-CG2 4.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.48Å; L383-V387 PolarHBondContact O-N 3.34Å; L383-A391 HydrophobicContact CB-CB 4.21Å; L383-A391 HydrophobicContact CD2-CB 3.94Å; L383-A391 HydrophobicContact CG-CB 3.68Å; L383-L394 HydrophobicContact CD2-CD2 3.61Å
384	I	97.6	Very high	95.5	Very high	57 Å²	57	37.5 Å²	37.5	29%	0.292	19%	0.191	S	C	.	.	H	α-helix	trans	-64.2	-43.1	174.4	-67	164.2	0	0	0	111.2	E380 A381 K386 G388 A391 K392	E380-I384 HydrophobicContact CG-CD1 4.19Å; E380-I384 WeakPolarHBondContact O-CD1 3.39Å; E380-I384 VanDerWaalsContact O-CG1 3.26Å; E380-I384 WeakPolarHBondContact O-CG1 3.4Å; E380-I384 PolarHBondContact O-N 2.92Å; A381-I384 PolarHBondContact O-N 3.11Å; I384-K386 PolarHBondContact O-N 2.74Å; I384-G388 WeakPolarHBondContact O-CA 3.39Å; I384-G388 PolarHBondContact O-N 2.88Å; I384-A391 HydrophobicContact CB-CB 4.29Å; I384-A391 HydrophobicContact CG1-CB 3.63Å; I384-K392 HydrophobicContact CD1-CG 4.16Å; I384-K392 HydrophobicContact CG1-CG 4.05Å; I384-K392 HydrophobicContact CG2-CG 4.46Å
385	E	96.8	Very high	96	Very high	131 Å²	131	38.8 Å²	38.8	61%	0.612	20%	0.197	S	C	*	.	H	α-helix	trans	-65.7	-26.4	176.3	-72	173.6	-172.1	0	0	112.1	R369 A381	R369-E385 IonicContact NH1-OE1 3Å; R369-E385 PolarHBondContact NH1-OE1 3.1Å; R369-E385 IonicContact NH1-OE2 2.82Å; A381-E385 WeakPolarHBondContact O-CB 3.5Å; A381-E385 VanDerWaalsContact O-CG 3.32Å; A381-E385 WeakPolarHBondContact O-CG 3.09Å; A381-E385 PolarHBondContact O-N 3.25Å
386	K	96.6	Very high	96.2	Very high	81 Å²	81	40.9 Å²	40.9	35%	0.352	21%	0.21	S	C	.	.	H	α-helix	trans	-89	-43.2	180	-179.5	176.9	-75.9	-64.8	0	114.8	G353 Q356 I357 A382 L383 I384	G353-K386 WeakPolarHBondContact O-CD 3.48Å; Q356-K386 HydrophobicContact CB-CD 3.86Å; I357-K386 HydrophobicContact CG1-CD 4.39Å; A382-K386 WeakPolarHBondContact O-CB 3.39Å; A382-K386 PolarHBondContact O-N 3.36Å; L383-K386 PolarHBondContact O-N 2.74Å; I384-K386 PolarHBondContact O-N 2.74Å
387	V	96.9	Very high	96.4	Very high	36 Å²	36	41.3 Å²	41.3	22%	0.218	21%	0.213	C	C	.	.	H	α-helix	trans	-123.7	-6.1	-173.1	-49.7	0	0	0	0	115.6	I349 L383 P390 A391	I349-V387 HydrophobicContact CG2-CB 3.58Å; I349-V387 HydrophobicContact CG2-CG1 3.91Å; I349-V387 HydrophobicContact CG2-CG2 3.95Å; L383-V387 HydrophobicContact CD1-CG2 4.28Å; L383-V387 HydrophobicContact CG-CG2 4.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.48Å; L383-V387 PolarHBondContact O-N 3.34Å; V387-P390 HydrophobicContact CG2-CB 4.5Å; V387-P390 WeakPolarHBondContact O-CD 3.46Å; V387-A391 HydrophobicContact CG2-CB 3.81Å
388	G	97	Very high	96.6	Very high	27 Å²	27	41.1 Å²	41.1	28%	0.278	21%	0.211	S	C	.	.			trans	75.4	-132.8	172.9	0	0	0	0	0	114.9	I384 A391	I384-G388 WeakPolarHBondContact O-CA 3.39Å; I384-G388 PolarHBondContact O-N 2.88Å; G388-A391 WeakPolarHBondContact O-CB 3.17Å; G388-A391 PolarHBondContact O-N 2.84Å
389	E	96.5	Very high	96.8	Very high	118 Å²	118	42 Å²	42	55%	0.551	22%	0.218	S	C	*	.	H	α-helix	trans	-58.3	-38.2	-170.8	-62.2	-54.2	131.3	0	0	115.7	A391 K392	E389-A391 VanDerWaalsContact C-N 3.27Å; E389-A391 PolarHBondContact O-N 3.09Å; E389-K392 VanDerWaalsContact CD-NZ 3.32Å; E389-K392 PolarHBondContact O-N 3.36Å; E389-K392 VanDerWaalsContact O-N 3.14Å; E389-K392 WeakPolarHBondContact OE1-CE 3.21Å; E389-K392 IonicContact OE1-NZ 2.71Å; E389-K392 PolarHBondContact OE1-NZ 3.06Å; E389-K392 WeakPolarHBondContact OE2-CD 3.37Å; E389-K392 IonicContact OE2-NZ 3.97Å; E389-K392 PolarHBondContact OE2-NZ 3.13Å
390	P	97.3	Very high	96.7	Very high	18 Å²	18	42.3 Å²	42.3	12%	0.117	22%	0.219	C	C	.	.	H	α-helix	trans	-53.1	-42.5	173.8	-29.3	37.2	0	0	0	113.2	D346 I349 I350 V387 K392 K393	D346-P390 HydrophobicContact CB-CB 4.28Å; I349-P390 HydrophobicContact CD1-CG 4.47Å; I349-P390 HydrophobicContact CG2-CB 4.11Å; I349-P390 HydrophobicContact CG2-CG 4.06Å; I350-P390 WeakPolarHBondContact CD1-O 3.27Å; I350-P390 HydrophobicContact CG1-CB 4.12Å; V387-P390 HydrophobicContact CG2-CB 4.5Å; V387-P390 WeakPolarHBondContact O-CD 3.46Å; P390-K392 VanDerWaalsContact C-N 3.28Å; P390-K392 PolarHBondContact O-N 2.98Å; P390-K393 WeakPolarHBondContact O-CB 3.49Å; P390-K393 PolarHBondContact O-N 3.13Å
391	A	97.6	Very high	96.8	Very high	3 Å²	3	41.1 Å²	41.1	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-39	179.1	0	0	0	0	0	112.7	L383 I384 V387 G388 E389 K393 L394	L383-A391 HydrophobicContact CB-CB 4.21Å; L383-A391 HydrophobicContact CD2-CB 3.94Å; L383-A391 HydrophobicContact CG-CB 3.68Å; I384-A391 HydrophobicContact CB-CB 4.29Å; I384-A391 HydrophobicContact CG1-CB 3.63Å; V387-A391 HydrophobicContact CG2-CB 3.81Å; G388-A391 WeakPolarHBondContact O-CB 3.17Å; G388-A391 PolarHBondContact O-N 2.84Å; E389-A391 VanDerWaalsContact C-N 3.27Å; E389-A391 PolarHBondContact O-N 3.09Å; A391-K393 PolarHBondContact O-N 2.92Å; A391-L394 WeakPolarHBondContact O-CB 3.44Å; A391-L394 PolarHBondContact O-N 3.3Å
392	K	96.4	Very high	96.9	Very high	107 Å²	107	40.4 Å²	40.4	47%	0.465	21%	0.208	S	C	.	.	H	α-helix	trans	-66.3	-22.1	-179.7	-58.7	-178.4	-170.2	166.7	0	112.9	I384 E389 P390 L394	I384-K392 HydrophobicContact CD1-CG 4.16Å; I384-K392 HydrophobicContact CG1-CG 4.05Å; I384-K392 HydrophobicContact CG2-CG 4.46Å; E389-K392 VanDerWaalsContact CD-NZ 3.32Å; E389-K392 PolarHBondContact O-N 3.36Å; E389-K392 VanDerWaalsContact O-N 3.14Å; E389-K392 WeakPolarHBondContact OE1-CE 3.21Å; E389-K392 IonicContact OE1-NZ 2.71Å; E389-K392 PolarHBondContact OE1-NZ 3.06Å; E389-K392 WeakPolarHBondContact OE2-CD 3.37Å; E389-K392 IonicContact OE2-NZ 3.97Å; E389-K392 PolarHBondContact OE2-NZ 3.13Å; P390-K392 VanDerWaalsContact C-N 3.28Å; P390-K392 PolarHBondContact O-N 2.98Å; K392-L394 VanDerWaalsContact C-N 3.29Å
393	K	97.4	Very high	97	Very high	77 Å²	77	39.5 Å²	39.5	34%	0.335	20%	0.2	S	C	.	.	H	α-helix	trans	-74	-21.2	175.1	-56.2	173.3	178	170.7	0	112.1	I342 D346 P390 A391 H395 T396	I342-K393 HydrophobicContact CB-CD 4.46Å; I342-K393 HydrophobicContact CG2-CB 3.56Å; I342-K393 HydrophobicContact CG2-CD 4Å; I342-K393 HydrophobicContact CG2-CG 4.34Å; D346-K393 HydrophobicContact CB-CD 4.41Å; D346-K393 IonicContact OD1-NZ 2.63Å; D346-K393 PolarHBondContact OD1-NZ 3.02Å; D346-K393 IonicContact OD2-NZ 3.28Å; D346-K393 PolarHBondContact OD2-NZ 2.92Å; P390-K393 WeakPolarHBondContact O-CB 3.49Å; P390-K393 PolarHBondContact O-N 3.13Å; A391-K393 PolarHBondContact O-N 2.92Å; K393-H395 VanDerWaalsContact C-N 3.29Å; K393-H395 PolarHBondContact O-N 3.41Å; K393-T396 WeakPolarHBondContact O-CB 3.48Å; K393-T396 PolarHBondContact O-N 2.94Å; K393-T396 PolarHBondContact O-OG1 3.46Å
394	L	97.4	Very high	96.9	Very high	9 Å²	9	40 Å²	40	5%	0.047	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-28.2	-173.7	-176.4	58.9	0	0	0	114.2	H332 A333 I350 L383 A391 K392 T396	H332-L394 PolarHBondContact CD2-O 3.42Å; H332-L394 VanDerWaalsContact CD2-O 3.24Å; A333-L394 HydrophobicContact CB-CD1 3.82Å; I350-L394 HydrophobicContact CG2-CD1 4.26Å; I350-L394 HydrophobicContact CG2-CD2 4.15Å; L383-L394 HydrophobicContact CD2-CD2 3.61Å; A391-L394 WeakPolarHBondContact O-CB 3.44Å; A391-L394 PolarHBondContact O-N 3.3Å; K392-L394 VanDerWaalsContact C-N 3.29Å; L394-T396 PolarHBondContact O-N 3.42Å
395	H	96.1	Very high	96.9	Very high	43 Å²	43	37.3 Å²	37.3	20%	0.199	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.4	176.7	-140.2	114.8	0	0	0	113.3	E380 K393 A397 R398	E380-H395 IonicContact OE1-CE1 2.63Å; E380-H395 IonicContact OE1-CG 2.87Å; E380-H395 IonicContact OE1-ND1 2.94Å; E380-H395 PolarHBondContact OE1-ND1 3.4Å; E380-H395 IonicContact OE2-CE1 3.85Å; E380-H395 IonicContact OE2-ND1 2.75Å; K393-H395 VanDerWaalsContact C-N 3.29Å; K393-H395 PolarHBondContact O-N 3.41Å; H395-A397 PolarHBondContact O-N 3.03Å; H395-R398 PolarHBondContact CD2-O 3.3Å; H395-R398 PolarHBondContact O-N 3.28Å; H395-R398 VanDerWaalsContact O-N 3.15Å
396	T	97.3	Very high	97	Very high	43 Å²	43	31.1 Å²	31.1	26%	0.264	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	131.2	176.6	-59.1	0	0	0	0	110.6	H332 L336 L341 K393 L394 R398 L496	H332-T396 PolarHBondContact NE2-O 3.34Å; L336-T396 HydrophobicContact CD2-CG2 4.07Å; L341-T396 HydrophobicContact CB-CG2 4.47Å; L341-T396 HydrophobicContact CD1-CG2 4.43Å; K393-T396 WeakPolarHBondContact O-CB 3.48Å; K393-T396 PolarHBondContact O-N 2.94Å; K393-T396 PolarHBondContact O-OG1 3.46Å; L394-T396 PolarHBondContact O-N 3.42Å; T396-R398 PolarHBondContact O-N 2.99Å; T396-R398 VanDerWaalsContact O-N 3.13Å; T396-L496 HydrophobicContact CG2-CD1 3.66Å
397	A	96.4	Very high	97	Very high	11 Å²	11	27.2 Å²	27.2	9%	0.091	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	25.8	-179.2	0	0	0	0	0	115.4	L336 H395 C489 T494 L496 I498	L336-A397 HydrophobicContact CD2-CB 4.49Å; H395-A397 PolarHBondContact O-N 3.03Å; A397-C489 VanDerWaalsContact C-SG 3.59Å; A397-C489 PolarHBondContact O-SG 3.29Å; A397-T494 HydrophobicContact CB-CG2 4.19Å; A397-L496 HydrophobicContact CB-CB 4.38Å; A397-L496 HydrophobicContact CB-CD1 4.09Å; A397-I498 HydrophobicContact CB-CG2 3.46Å; A397-I498 VanDerWaalsContact CB-CG2 3.46Å
398	R	96.9	Very high	97.1	Very high	19 Å²	19	25.5 Å²	25.5	7%	0.072	13%	0.133	C	C	.	.			trans	-127	160.9	172.9	-168.8	161.1	71.9	162.8	2	110	S329 H395 T396 Q403 L486	S329-R398 PolarHBondContact OG-NH1 2.96Å; S329-R398 PolarHBondContact OG-NH2 2.77Å; H395-R398 PolarHBondContact CD2-O 3.3Å; H395-R398 PolarHBondContact O-N 3.28Å; H395-R398 VanDerWaalsContact O-N 3.15Å; T396-R398 PolarHBondContact O-N 2.99Å; T396-R398 VanDerWaalsContact O-N 3.13Å; R398-Q403 HydrophobicContact CG-CB 4.34Å; R398-L486 HydrophobicContact CG-CD1 4.12Å
399	S	96.5	Very high	97.1	Very high	22 Å²	22	24.4 Å²	24.4	15%	0.154	12%	0.12	C	C	.	.			trans	-131.8	166.6	163.3	-172.1	0	0	0	0	108.7	N401 D402 Q403	S399-N401 PolarHBondContact O-N 3.11Å; S399-N401 PolarHBondContact OG-N 3.01Å; S399-D402 WeakPolarHBondContact CA-OD1 3.45Å; S399-D402 WeakPolarHBondContact CB-OD1 3.42Å; S399-D402 PolarHBondContact N-OD1 3.16Å; S399-Q403 WeakPolarHBondContact O-CB 3.33Å; S399-Q403 PolarHBondContact O-N 2.95Å
400	R	94.9	Very high	97.2	Very high	10 Å²	10	19 Å²	19	4%	0.038	10%	0.095	C	C	.	.	H	α-helix	trans	-61.3	-31.1	166	-173.7	71.1	81.6	-111.6	2.9	111.3	W295 D374 E380 Q403 I404	W295-R400 HydrophobicContact CZ2-CB 3.94Å; W295-R400 HydrophobicContact CZ2-CG 4.31Å; D374-R400 VanDerWaalsContact CG-NE 3.34Å; D374-R400 IonicContact OD1-CZ 2.91Å; D374-R400 IonicContact OD1-NE 3.14Å; D374-R400 PolarHBondContact OD1-NE 3.26Å; D374-R400 IonicContact OD1-NH2 3.73Å; D374-R400 PolarHBondContact OD1-NH2 3.07Å; D374-R400 IonicContact OD2-CZ 2.74Å; D374-R400 IonicContact OD2-NE 3.85Å; D374-R400 PolarHBondContact OD2-NE 2.9Å; D374-R400 IonicContact OD2-NH2 3.81Å; D374-R400 PolarHBondContact OD2-NH2 2.85Å; E380-R400 IonicContact OE2-NH1 3.75Å; E380-R400 IonicContact OE2-NH2 2.8Å; R400-Q403 PolarHBondContact O-N 3.36Å; R400-I404 VanDerWaalsContact O-CG2 3.28Å; R400-I404 WeakPolarHBondContact O-CG2 3.43Å; R400-I404 PolarHBondContact O-N 2.84Å
401	N	97.2	Very high	97.3	Very high	13 Å²	13	18.6 Å²	18.6	7%	0.07	9%	0.091	C	C	.	.	H	α-helix	trans	-62.1	-48.8	-175.9	-68.5	7.7	0	0	0	113.3	W295 S399 V405 A490 V520	W295-N401 VanDerWaalsContact CH2-OD1 3.25Å; W295-N401 WeakPolarHBondContact CH2-OD1 3.48Å; W295-N401 VanDerWaalsContact CZ2-OD1 3.32Å; W295-N401 WeakPolarHBondContact CZ2-OD1 3.34Å; S399-N401 PolarHBondContact O-N 3.11Å; S399-N401 PolarHBondContact OG-N 3.01Å; N401-V405 WeakPolarHBondContact O-CG2 3.31Å; N401-A490 PolarHBondContact ND2-O 2.73Å; N401-V520 HydrophobicContact CB-CB 4.09Å; N401-V520 HydrophobicContact CB-CG1 3.86Å
402	D	98	Very high	97.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-83.7	-23.2	177.7	64.6	-38	0	0	0	112.8	S399 T406 G487 A488 C489 V520	S399-D402 WeakPolarHBondContact CA-OD1 3.45Å; S399-D402 WeakPolarHBondContact CB-OD1 3.42Å; S399-D402 PolarHBondContact N-OD1 3.16Å; D402-T406 WeakPolarHBondContact O-CB 3.29Å; D402-T406 PolarHBondContact O-N 3.45Å; D402-T406 VanDerWaalsContact O-N 3.14Å; D402-T406 PolarHBondContact O-OG1 3.18Å; D402-G487 WeakPolarHBondContact OD2-CA 3.43Å; D402-G487 PolarHBondContact OD2-N 2.94Å; D402-A488 HydrophobicContact CB-CB 4.01Å; D402-A488 PolarHBondContact OD2-N 3.45Å; D402-C489 VanDerWaalsContact CG-CA 3.47Å; D402-C489 VanDerWaalsContact OD1-CA 3.32Å; D402-C489 WeakPolarHBondContact OD1-CA 3.3Å; D402-C489 PolarHBondContact OD2-N 3.47Å; D402-V520 HydrophobicContact CB-CG1 4.29Å
403	Q	97.8	Very high	97.4	Very high	2 Å²	2	14.6 Å²	14.6	1%	0.009	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-61.4	168.3	-173.9	178.6	18	0	0	111	D325 H376 R398 S399 R400 V405 T406 D407	D325-Q403 PolarHBondContact OD1-NE2 2.92Å; H376-Q403 VanDerWaalsContact CD2-CD 3.5Å; H376-Q403 PolarHBondContact CD2-NE2 3.04Å; R398-Q403 HydrophobicContact CG-CB 4.34Å; S399-Q403 WeakPolarHBondContact O-CB 3.33Å; S399-Q403 PolarHBondContact O-N 2.95Å; R400-Q403 PolarHBondContact O-N 3.36Å; Q403-V405 VanDerWaalsContact C-N 3.32Å; Q403-V405 PolarHBondContact O-N 2.95Å; Q403-T406 WeakPolarHBondContact O-CA 3.43Å; Q403-T406 VanDerWaalsContact O-CB 3.23Å; Q403-T406 WeakPolarHBondContact O-CB 3.4Å; Q403-T406 PolarHBondContact O-N 2.83Å; Q403-D407 PolarHBondContact O-N 3.26Å; Q403-D407 VanDerWaalsContact O-OD2 3.13Å
404	I	96.1	Very high	97.5	Very high	14 Å²	14	13.4 Å²	13.4	7%	0.072	7%	0.07	C	C	.	.	H	α-helix	trans	-60.3	-36.9	-175.6	-172.1	48	0	0	0	113.4	L321 R400 T406 D407 L408 K616	L321-I404 HydrophobicContact CD1-CD1 3.59Å; R400-I404 VanDerWaalsContact O-CG2 3.28Å; R400-I404 WeakPolarHBondContact O-CG2 3.43Å; R400-I404 PolarHBondContact O-N 2.84Å; I404-T406 VanDerWaalsContact C-N 3.3Å; I404-T406 PolarHBondContact O-N 2.98Å; I404-D407 PolarHBondContact O-N 2.97Å; I404-L408 VanDerWaalsContact O-CB 3.26Å; I404-L408 WeakPolarHBondContact O-CB 3.17Å; I404-L408 PolarHBondContact O-N 3.09Å; I404-K616 HydrophobicContact CD1-CD 4.29Å
405	V	97.7	Very high	97.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-74.9	-22.2	177	-170.1	0	0	0	0	111.4	N401 Q403 R409 P485 F525	N401-V405 WeakPolarHBondContact O-CG2 3.31Å; Q403-V405 VanDerWaalsContact C-N 3.32Å; Q403-V405 PolarHBondContact O-N 2.95Å; V405-R409 WeakPolarHBondContact O-CD 3.3Å; V405-R409 WeakPolarHBondContact O-CG 3.42Å; V405-R409 PolarHBondContact O-N 3.25Å; V405-P485 VanDerWaalsContact C-CG 3.46Å; V405-P485 HydrophobicContact CB-CB 4.42Å; V405-P485 HydrophobicContact CB-CG 4.01Å; V405-P485 HydrophobicContact CG1-CB 4.38Å; V405-P485 HydrophobicContact CG1-CG 4.01Å; V405-F525 HydrophobicContact CG1-CE1 4.02Å; V405-F525 HydrophobicContact CG1-CZ 4.19Å
406	T	98.4	Very high	97.7	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-69.4	-52.2	167.8	-58.1	0	0	0	0	109.7	C328 D402 Q403 I404 L408 R409 L410 P485 L486 L507 F509	C328-T406 HydrophobicContact CB-CG2 4.5Å; D402-T406 WeakPolarHBondContact O-CB 3.29Å; D402-T406 PolarHBondContact O-N 3.45Å; D402-T406 VanDerWaalsContact O-N 3.14Å; D402-T406 PolarHBondContact O-OG1 3.18Å; Q403-T406 WeakPolarHBondContact O-CA 3.43Å; Q403-T406 VanDerWaalsContact O-CB 3.23Å; Q403-T406 WeakPolarHBondContact O-CB 3.4Å; Q403-T406 PolarHBondContact O-N 2.83Å; I404-T406 VanDerWaalsContact C-N 3.3Å; I404-T406 PolarHBondContact O-N 2.98Å; T406-L408 PolarHBondContact O-N 3.09Å; T406-R409 PolarHBondContact O-N 2.73Å; T406-L410 HydrophobicContact CG2-CD1 4.18Å; T406-L410 WeakPolarHBondContact O-CG 3.5Å; T406-L410 PolarHBondContact O-N 2.94Å; T406-P485 WeakPolarHBondContact OG1-CG 3.36Å; T406-L486 HydrophobicContact CG2-CB 4.4Å; T406-L486 WeakPolarHBondContact OG1-CB 3.35Å; T406-L486 PolarHBondContact OG1-N 2.77Å; T406-L507 HydrophobicContact CG2-CD1 3.81Å; T406-F509 HydrophobicContact CG2-CE2 3.96Å; T406-F509 HydrophobicContact CG2-CZ 4.36Å
407	D	98	Very high	97.7	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.6	-45.2	-175.7	-48.3	-31.6	0	0	0	110.9	H324 C328 H376 Q403 I404 R409 L410 W411	H324-D407 HydrophobicContact CB-CB 3.98Å; C328-D407 VanDerWaalsContact CB-OD1 3.26Å; C328-D407 WeakPolarHBondContact CB-OD1 3.38Å; H376-D407 IonicContact CD2-OD2 3.43Å; H376-D407 PolarHBondContact CD2-OD2 2.93Å; H376-D407 IonicContact CE1-OD2 3.19Å; H376-D407 IonicContact NE2-OD2 2.85Å; H376-D407 PolarHBondContact NE2-OD2 3.11Å; Q403-D407 PolarHBondContact O-N 3.26Å; Q403-D407 VanDerWaalsContact O-OD2 3.13Å; I404-D407 PolarHBondContact O-N 2.97Å; D407-R409 VanDerWaalsContact C-N 3.33Å; D407-R409 PolarHBondContact O-N 3.43Å; D407-L410 WeakPolarHBondContact O-CB 3.34Å; D407-L410 PolarHBondContact O-N 3.17Å; D407-W411 WeakPolarHBondContact O-CB 3.4Å; D407-W411 PolarHBondContact O-N 2.97Å
408	L	97.7	Very high	97.8	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.5	-33	179.5	-160.8	65.4	0	0	0	112.8	L321 I404 T406 C412 F525 V526 K616 L619 F620	L321-L408 HydrophobicContact CD2-CD1 4.35Å; I404-L408 VanDerWaalsContact O-CB 3.26Å; I404-L408 WeakPolarHBondContact O-CB 3.17Å; I404-L408 PolarHBondContact O-N 3.09Å; T406-L408 PolarHBondContact O-N 3.09Å; L408-C412 WeakPolarHBondContact O-CB 3.35Å; L408-C412 PolarHBondContact O-N 3.44Å; L408-C412 PolarHBondContact O-SG 2.97Å; L408-F525 HydrophobicContact CB-CZ 4.44Å; L408-F525 HydrophobicContact CD2-CE2 4.43Å; L408-F525 HydrophobicContact CD2-CZ 4.17Å; L408-F525 HydrophobicContact CG-CE2 4.32Å; L408-F525 HydrophobicContact CG-CZ 4.4Å; L408-V526 HydrophobicContact CD2-CG2 4.07Å; L408-K616 HydrophobicContact CD1-CG 3.94Å; L408-L619 HydrophobicContact CD1-CD2 3.78Å; L408-L619 HydrophobicContact CD2-CD2 4.17Å; L408-L619 HydrophobicContact CG-CD2 4Å; L408-F620 HydrophobicContact CD1-CE1 3.91Å; L408-F620 HydrophobicContact CD1-CZ 4.33Å
409	R	98.5	Very high	97.9	Very high	4 Å²	4	15.6 Å²	15.6	2%	0.015	8%	0.076	C	C	.	.	H	α-helix	trans	-70.9	-38.5	173.2	-75.4	174	-170.4	-81.4	-7.8	112.3	V405 T406 D407 C412 R413 L481 F483 F509 M513 D522 F525	V405-R409 WeakPolarHBondContact O-CD 3.3Å; V405-R409 WeakPolarHBondContact O-CG 3.42Å; V405-R409 PolarHBondContact O-N 3.25Å; T406-R409 PolarHBondContact O-N 2.73Å; D407-R409 VanDerWaalsContact C-N 3.33Å; D407-R409 PolarHBondContact O-N 3.43Å; R409-C412 PolarHBondContact O-N 2.65Å; R409-R413 WeakPolarHBondContact O-CB 3.44Å; R409-R413 PolarHBondContact O-N 3.47Å; R409-L481 WeakPolarHBondContact CD-O 3.42Å; R409-L481 PolarHBondContact NH1-O 2.98Å; R409-L481 WeakPolarHBondContact O-CD1 3.48Å; R409-F483 VanDerWaalsContact CD-O 3.25Å; R409-F483 WeakPolarHBondContact CD-O 3.49Å; R409-F509 HydrophobicContact CB-CE1 3.93Å; R409-F509 HydrophobicContact CB-CZ 4Å; R409-M513 VanDerWaalsContact CZ-SD 3.57Å; R409-M513 PolarHBondContact NH2-SD 3.24Å; R409-D522 IonicContact CZ-OD2 3.43Å; R409-D522 IonicContact NH1-OD2 2.78Å; R409-D522 IonicContact NH2-OD2 3.6Å; R409-D522 PolarHBondContact NH2-OD2 3.34Å; R409-F525 HydrophobicContact CG-CD2 4.03Å; R409-F525 HydrophobicContact CG-CE1 4.18Å; R409-F525 HydrophobicContact CG-CE2 3.66Å; R409-F525 HydrophobicContact CG-CG 4.44Å; R409-F525 HydrophobicContact CG-CZ 3.74Å
410	L	98.4	Very high	98	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.026	7%	0.074	C	C	.	.	H	α-helix	trans	-63	-47.8	173.9	-64.2	170.1	0	0	0	110	H324 T406 D407 C412 R413 D414 L507 F509	H324-L410 HydrophobicContact CB-CB 4.24Å; H324-L410 HydrophobicContact CB-CD1 4.34Å; H324-L410 VanDerWaalsContact CD2-CB 3.42Å; H324-L410 WeakPolarHBondContact CD2-CB 3.37Å; T406-L410 HydrophobicContact CG2-CD1 4.18Å; T406-L410 WeakPolarHBondContact O-CG 3.5Å; T406-L410 PolarHBondContact O-N 2.94Å; D407-L410 WeakPolarHBondContact O-CB 3.34Å; D407-L410 PolarHBondContact O-N 3.17Å; L410-C412 PolarHBondContact O-N 3.32Å; L410-R413 VanDerWaalsContact CD2-NH2 3.26Å; L410-R413 WeakPolarHBondContact O-CB 3.14Å; L410-R413 PolarHBondContact O-N 3.43Å; L410-D414 VanDerWaalsContact O-CG 3.28Å; L410-D414 PolarHBondContact O-N 3.08Å; L410-D414 VanDerWaalsContact O-N 3.08Å; L410-L507 HydrophobicContact CD1-CD1 4.48Å; L410-L507 HydrophobicContact CD1-CD2 4.14Å; L410-L507 HydrophobicContact CD2-CB 4.33Å; L410-F509 HydrophobicContact CD2-CE1 4.31Å; L410-F509 HydrophobicContact CD2-CE2 3.68Å; L410-F509 HydrophobicContact CD2-CZ 3.55Å; L410-F509 HydrophobicContact CG-CE2 4.12Å; L410-F509 HydrophobicContact CG-CZ 3.81Å
411	W	98.4	Very high	98.2	Very high	8 Å²	8	19.7 Å²	19.7	3%	0.03	9%	0.093	C	C	.	.	H	α-helix	trans	-57.8	-46.9	174.6	-175.3	98.3	0	0	0	112.1	E320 L321 H324 D407 R413 D414 A415 F529 L619 F620 V623	E320-W411 VanDerWaalsContact O-CD1 3.28Å; E320-W411 PolarHBondContact OE2-NE1 2.91Å; L321-W411 HydrophobicContact CD2-CB 3.76Å; L321-W411 HydrophobicContact CD2-CG 3.88Å; H324-W411 AromaticContact CE1-CD1 3.78Å; H324-W411 AromaticContact ND1-CD1 3.92Å; D407-W411 WeakPolarHBondContact O-CB 3.4Å; D407-W411 PolarHBondContact O-N 2.97Å; W411-R413 VanDerWaalsContact C-N 3.33Å; W411-R413 PolarHBondContact O-N 2.85Å; W411-D414 PolarHBondContact O-N 2.82Å; W411-A415 HydrophobicContact CD2-CB 4.44Å; W411-A415 HydrophobicContact CE3-CB 4.08Å; W411-A415 HydrophobicContact CH2-CB 4.06Å; W411-A415 HydrophobicContact CZ2-CB 4.43Å; W411-A415 HydrophobicContact CZ3-CB 3.86Å; W411-A415 VanDerWaalsContact O-CB 3.23Å; W411-A415 WeakPolarHBondContact O-CB 3.23Å; W411-A415 PolarHBondContact O-N 3.41Å; W411-F529 HydrophobicContact CZ3-CE1 4.19Å; W411-L619 HydrophobicContact CE3-CD2 4.28Å; W411-L619 HydrophobicContact CE3-CG 4.36Å; W411-L619 HydrophobicContact CH2-CG 4.21Å; W411-L619 HydrophobicContact CZ3-CD1 3.87Å; W411-L619 HydrophobicContact CZ3-CD2 4.01Å; W411-L619 HydrophobicContact CZ3-CG 3.61Å; W411-F620 HydrophobicContact CD2-CD1 4.17Å; W411-F620 AromaticContact CD2-CE1 3.94Å; W411-F620 HydrophobicContact CD2-CE1 3.94Å; W411-F620 AromaticContact CE2-CD1 3.73Å; W411-F620 AromaticContact CE2-CE1 3.83Å; W411-F620 HydrophobicContact CE3-CD1 4.27Å; W411-F620 HydrophobicContact CE3-CE1 4.21Å; W411-F620 HydrophobicContact CG-CE1 4.46Å; W411-F620 AromaticContact CH2-CD1 3.6Å; W411-F620 HydrophobicContact CH2-CD1 3.6Å; W411-F620 HydrophobicContact CH2-CE1 4.32Å; W411-F620 HydrophobicContact CZ2-CB 4.45Å; W411-F620 AromaticContact CZ2-CD1 3.44Å; W411-F620 HydrophobicContact CZ2-CD1 3.44Å; W411-F620 VanDerWaalsContact CZ2-CD1 3.44Å; W411-F620 HydrophobicContact CZ2-CE1 4.04Å; W411-F620 HydrophobicContact CZ2-CG 4.25Å; W411-F620 HydrophobicContact CZ3-CD1 4.03Å; W411-F620 HydrophobicContact CZ3-CE1 4.41Å; W411-V623 HydrophobicContact CH2-CB 3.71Å; W411-V623 HydrophobicContact CH2-CG1 3.97Å; W411-V623 HydrophobicContact CH2-CG2 3.56Å; W411-V623 HydrophobicContact CZ2-CB 4.44Å; W411-V623 HydrophobicContact CZ2-CG1 4.34Å; W411-V623 HydrophobicContact CZ3-CG2 3.94Å
412	C	98.7	Very high	98.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.8	-39.5	177.4	-75.7	0	0	0	0	112.6	L408 R409 L410 A415 I416 L481 F529	L408-C412 WeakPolarHBondContact O-CB 3.35Å; L408-C412 PolarHBondContact O-N 3.44Å; L408-C412 PolarHBondContact O-SG 2.97Å; R409-C412 PolarHBondContact O-N 2.65Å; L410-C412 PolarHBondContact O-N 3.32Å; C412-A415 PolarHBondContact O-N 3.14Å; C412-I416 WeakPolarHBondContact O-CB 3.49Å; C412-I416 WeakPolarHBondContact O-CG1 3.4Å; C412-I416 PolarHBondContact O-N 3.43Å; C412-L481 HydrophobicContact CB-CD2 3.9Å; C412-F529 HydrophobicContact CB-CD1 4.11Å; C412-F529 HydrophobicContact CB-CE1 4.24Å
413	R	98.3	Very high	98.3	Very high	27 Å²	27	22.7 Å²	22.7	10%	0.102	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-49.4	176.6	-171.7	175.9	65	-162.8	0.7	111	R409 L410 W411 A415 I416 D417 R478 L481 N482 L507 K508	R409-R413 WeakPolarHBondContact O-CB 3.44Å; R409-R413 PolarHBondContact O-N 3.47Å; L410-R413 VanDerWaalsContact CD2-NH2 3.26Å; L410-R413 WeakPolarHBondContact O-CB 3.14Å; L410-R413 PolarHBondContact O-N 3.43Å; W411-R413 VanDerWaalsContact C-N 3.33Å; W411-R413 PolarHBondContact O-N 2.85Å; R413-A415 VanDerWaalsContact C-N 3.33Å; R413-A415 PolarHBondContact O-N 2.99Å; R413-I416 PolarHBondContact O-N 3.09Å; R413-D417 PolarHBondContact O-N 3.14Å; R413-R478 HydrophobicContact CG-CG 4.25Å; R413-L481 HydrophobicContact CB-CD1 4Å; R413-N482 WeakPolarHBondContact CD-OD1 3.48Å; R413-N482 PolarHBondContact NH1-OD1 3.22Å; R413-L507 PolarHBondContact NH1-O 3.09Å; R413-L507 PolarHBondContact NH2-O 2.93Å; R413-K508 PolarHBondContact NH1-O 3.32Å
414	D	98.2	Very high	98.4	Very high	52 Å²	52	26.8 Å²	26.8	28%	0.278	12%	0.121	S	C	.	.	H	α-helix	trans	-69.9	-31.9	-178.6	-57.9	-10	0	0	0	111.5	H324 L410 W411 K418	H324-D414 IonicContact CD2-OD2 2.68Å; H324-D414 IonicContact CE1-OD2 3.77Å; H324-D414 IonicContact NE2-OD2 3.36Å; H324-D414 PolarHBondContact NE2-OD2 3.1Å; L410-D414 VanDerWaalsContact O-CG 3.28Å; L410-D414 PolarHBondContact O-N 3.08Å; L410-D414 VanDerWaalsContact O-N 3.08Å; W411-D414 PolarHBondContact O-N 2.82Å; D414-K418 WeakPolarHBondContact O-CD 3.41Å; D414-K418 VanDerWaalsContact O-CG 3.26Å; D414-K418 WeakPolarHBondContact O-CG 3.5Å; D414-K418 PolarHBondContact O-N 2.98Å; D414-K418 VanDerWaalsContact O-N 3.12Å
415	A	98.6	Very high	98.5	Very high	2 Å²	2	29.1 Å²	29.1	2%	0.017	13%	0.132	C	C	.	.	H	α-helix	trans	-68.7	-41.8	173.2	0	0	0	0	0	112.5	W411 C412 R413 K418 I419 F529 V623	W411-A415 HydrophobicContact CD2-CB 4.44Å; W411-A415 HydrophobicContact CE3-CB 4.08Å; W411-A415 HydrophobicContact CH2-CB 4.06Å; W411-A415 HydrophobicContact CZ2-CB 4.43Å; W411-A415 HydrophobicContact CZ3-CB 3.86Å; W411-A415 VanDerWaalsContact O-CB 3.23Å; W411-A415 WeakPolarHBondContact O-CB 3.23Å; W411-A415 PolarHBondContact O-N 3.41Å; C412-A415 PolarHBondContact O-N 3.14Å; R413-A415 VanDerWaalsContact C-N 3.33Å; R413-A415 PolarHBondContact O-N 2.99Å; A415-K418 PolarHBondContact O-N 3.44Å; A415-I419 WeakPolarHBondContact O-CG1 3.42Å; A415-I419 PolarHBondContact O-N 2.85Å; A415-F529 HydrophobicContact CB-CE1 3.9Å; A415-F529 HydrophobicContact CB-CZ 3.87Å; A415-V623 HydrophobicContact CB-CG1 3.99Å; A415-V623 HydrophobicContact CB-CG2 4.2Å
416	I	98.9	Very high	98.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-46.5	172	-75.1	176.9	0	0	0	110.3	C412 R413 K418 I419 L420 L474 C477 R478 L481 F529	C412-I416 WeakPolarHBondContact O-CB 3.49Å; C412-I416 WeakPolarHBondContact O-CG1 3.4Å; C412-I416 PolarHBondContact O-N 3.43Å; R413-I416 PolarHBondContact O-N 3.09Å; I416-K418 VanDerWaalsContact C-N 3.31Å; I416-K418 PolarHBondContact O-N 2.99Å; I416-I419 PolarHBondContact O-N 2.91Å; I416-I419 VanDerWaalsContact O-N 3.09Å; I416-L420 HydrophobicContact CG2-CD1 3.67Å; I416-L420 HydrophobicContact CG2-CG 4.06Å; I416-L420 WeakPolarHBondContact O-CB 3.3Å; I416-L420 WeakPolarHBondContact O-CG 3.09Å; I416-L420 PolarHBondContact O-N 3.21Å; I416-L474 HydrophobicContact CG1-CD2 4.18Å; I416-L474 HydrophobicContact CG2-CB 4.06Å; I416-C477 HydrophobicContact CD1-CB 4.27Å; I416-R478 HydrophobicContact CD1-CB 4.17Å; I416-R478 HydrophobicContact CG2-CB 4.14Å; I416-R478 HydrophobicContact CG2-CG 4.31Å; I416-L481 HydrophobicContact CD1-CD2 3.59Å; I416-F529 HydrophobicContact CD1-CD2 4.3Å; I416-F529 HydrophobicContact CD1-CE2 4.41Å; I416-F529 HydrophobicContact CD1-CG 4.45Å; I416-F529 HydrophobicContact CG1-CD1 4.42Å; I416-F529 HydrophobicContact CG1-CD2 3.92Å; I416-F529 HydrophobicContact CG1-CE1 4.09Å; I416-F529 HydrophobicContact CG1-CE2 3.55Å; I416-F529 HydrophobicContact CG1-CG 4.35Å; I416-F529 HydrophobicContact CG1-CZ 3.63Å
417	D	98.5	Very high	98.5	Very high	58 Å²	58	29.5 Å²	29.5	31%	0.31	13%	0.133	S	C	.	.	H	α-helix	trans	-62.7	-37.8	-178.7	-69.6	-17.7	0	0	0	112.1	R413 F421 R478	R413-D417 PolarHBondContact O-N 3.14Å; D417-F421 PolarHBondContact O-N 3.44Å; D417-F421 VanDerWaalsContact O-N 3.1Å; D417-R478 WeakPolarHBondContact OD1-CD 3.19Å; D417-R478 IonicContact OD1-CZ 3.93Å; D417-R478 IonicContact OD1-NE 3.72Å; D417-R478 PolarHBondContact OD1-NE 3.13Å; D417-R478 IonicContact OD1-NH2 2.73Å; D417-R478 PolarHBondContact OD1-NH2 3.2Å; D417-R478 IonicContact OD2-CZ 3.82Å; D417-R478 IonicContact OD2-NE 3.14Å; D417-R478 PolarHBondContact OD2-NE 3.18Å; D417-R478 IonicContact OD2-NH2 3.01Å; D417-R478 PolarHBondContact OD2-NH2 3.49Å
418	K	98.6	Very high	98.6	Very high	110 Å²	110	31.1 Å²	31.1	48%	0.478	14%	0.143	S	C	.	.	H	α-helix	trans	-62.3	-44.6	170.6	-69.3	164.1	-171.8	172.4	0	112.4	D414 A415 I416 F421 R422 L627	D414-K418 WeakPolarHBondContact O-CD 3.41Å; D414-K418 VanDerWaalsContact O-CG 3.26Å; D414-K418 WeakPolarHBondContact O-CG 3.5Å; D414-K418 PolarHBondContact O-N 2.98Å; D414-K418 VanDerWaalsContact O-N 3.12Å; A415-K418 PolarHBondContact O-N 3.44Å; I416-K418 VanDerWaalsContact C-N 3.31Å; I416-K418 PolarHBondContact O-N 2.99Å; K418-F421 PolarHBondContact O-N 2.9Å; K418-R422 PolarHBondContact O-N 3.39Å; K418-L627 HydrophobicContact CB-CD1 4.5Å; K418-L627 HydrophobicContact CB-CD2 4.07Å
419	I	98.9	Very high	98.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-68	-41.8	-179.9	-68.5	170	0	0	0	111	A415 I416 F421 R422 I423 L474 F529 V623 V626 L627 L630	A415-I419 WeakPolarHBondContact O-CG1 3.42Å; A415-I419 PolarHBondContact O-N 2.85Å; I416-I419 PolarHBondContact O-N 2.91Å; I416-I419 VanDerWaalsContact O-N 3.09Å; I419-F421 VanDerWaalsContact C-N 3.31Å; I419-F421 PolarHBondContact O-N 2.94Å; I419-R422 PolarHBondContact O-N 2.89Å; I419-I423 HydrophobicContact CG2-CD1 3.89Å; I419-I423 HydrophobicContact CG2-CG1 4.3Å; I419-I423 WeakPolarHBondContact O-CG1 3.4Å; I419-I423 PolarHBondContact O-N 2.95Å; I419-L474 HydrophobicContact CB-CD1 4.36Å; I419-L474 HydrophobicContact CG2-CD1 3.51Å; I419-F529 HydrophobicContact CD1-CE2 3.82Å; I419-F529 HydrophobicContact CD1-CZ 3.89Å; I419-V623 HydrophobicContact CD1-CG1 4.22Å; I419-V623 HydrophobicContact CD1-CG2 4.16Å; I419-V626 HydrophobicContact CD1-CB 4.5Å; I419-V626 HydrophobicContact CD1-CG1 4.16Å; I419-V626 HydrophobicContact CG1-CG1 4.35Å; I419-V626 HydrophobicContact CG2-CG1 4.01Å; I419-L627 HydrophobicContact CB-CD2 4.36Å; I419-L627 HydrophobicContact CG1-CD2 3.59Å; I419-L627 HydrophobicContact CG1-CG 3.85Å; I419-L630 HydrophobicContact CG2-CD1 3.97Å
420	L	98.8	Very high	98.6	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.115	15%	0.145	C	C	.	.	H	α-helix	trans	-57.8	-43.2	174.5	-72.7	172.6	0	0	0	111.7	I416 I423 K424 A471 L474 V475	I416-L420 HydrophobicContact CG2-CD1 3.67Å; I416-L420 HydrophobicContact CG2-CG 4.06Å; I416-L420 WeakPolarHBondContact O-CB 3.3Å; I416-L420 WeakPolarHBondContact O-CG 3.09Å; I416-L420 PolarHBondContact O-N 3.21Å; L420-I423 PolarHBondContact O-N 2.84Å; L420-K424 PolarHBondContact O-N 3.02Å; L420-A471 HydrophobicContact CD2-CB 3.65Å; L420-L474 HydrophobicContact CD2-CB 3.96Å; L420-L474 HydrophobicContact CD2-CD1 4.36Å; L420-L474 HydrophobicContact CG-CB 4.37Å; L420-V475 HydrophobicContact CD1-CG2 3.96Å; L420-V475 HydrophobicContact CD2-CG2 4.1Å
421	F	98.6	Very high	98.6	Very high	96 Å²	96	31 Å²	31	42%	0.421	14%	0.144	S	C	.	.	H	α-helix	trans	-61.7	-46.8	174.6	-179.2	-101.9	0	0	0	112.3	D417 K418 I419 I423 K424 Q425	D417-F421 PolarHBondContact O-N 3.44Å; D417-F421 VanDerWaalsContact O-N 3.1Å; K418-F421 PolarHBondContact O-N 2.9Å; I419-F421 VanDerWaalsContact C-N 3.31Å; I419-F421 PolarHBondContact O-N 2.94Å; F421-I423 PolarHBondContact O-N 3.42Å; F421-K424 PolarHBondContact O-N 3.02Å; F421-Q425 HydrophobicContact CD1-CG 4.44Å; F421-Q425 HydrophobicContact CE1-CG 4.08Å; F421-Q425 VanDerWaalsContact CE1-OE1 3.26Å; F421-Q425 HydrophobicContact CZ-CG 4.19Å; F421-Q425 WeakPolarHBondContact O-CG 3.44Å; F421-Q425 PolarHBondContact O-N 3.27Å
422	R	98.7	Very high	98.6	Very high	74 Å²	74	34.3 Å²	34.3	28%	0.279	16%	0.161	S	C	.	.	H	α-helix	trans	-65.3	-36.1	176.9	-69.3	-53.2	-163.7	-147.2	1.2	113.1	K418 I419 Q425 F426 L627 L630 E631	K418-R422 PolarHBondContact O-N 3.39Å; I419-R422 PolarHBondContact O-N 2.89Å; R422-Q425 VanDerWaalsContact CD-OE1 3.28Å; R422-Q425 PolarHBondContact O-N 2.76Å; R422-F426 PolarHBondContact O-N 2.73Å; R422-L627 HydrophobicContact CB-CD2 4.33Å; R422-L627 HydrophobicContact CG-CD2 3.72Å; R422-L630 HydrophobicContact CB-CB 3.84Å; R422-L630 HydrophobicContact CB-CD1 3.83Å; R422-L630 HydrophobicContact CB-CG 4.44Å; R422-E631 HydrophobicContact CG-CG 4.46Å; R422-E631 IonicContact CZ-OE1 3.49Å; R422-E631 VanDerWaalsContact NE-CG 3.34Å; R422-E631 IonicContact NE-OE1 2.76Å; R422-E631 PolarHBondContact NE-OE1 3.34Å; R422-E631 IonicContact NH2-OE1 3.58Å; R422-E631 PolarHBondContact NH2-OE1 3.5Å
423	I	98.8	Very high	98.6	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-58.2	-49.6	171.1	-74.4	170.8	0	0	0	110	I419 L420 F421 Q425 F426 Q427 L467 D470 A471 L474 L630	I419-I423 HydrophobicContact CG2-CD1 3.89Å; I419-I423 HydrophobicContact CG2-CG1 4.3Å; I419-I423 WeakPolarHBondContact O-CG1 3.4Å; I419-I423 PolarHBondContact O-N 2.95Å; L420-I423 PolarHBondContact O-N 2.84Å; F421-I423 PolarHBondContact O-N 3.42Å; I423-Q425 PolarHBondContact O-N 3.46Å; I423-F426 PolarHBondContact O-N 2.78Å; I423-F426 VanDerWaalsContact O-N 3.15Å; I423-Q427 HydrophobicContact CG2-CG 4.26Å; I423-Q427 WeakPolarHBondContact O-CG 3.16Å; I423-Q427 PolarHBondContact O-N 3.4Å; I423-L467 HydrophobicContact CG2-CB 4.02Å; I423-D470 HydrophobicContact CD1-CB 4.39Å; I423-A471 HydrophobicContact CD1-CB 4.42Å; I423-A471 HydrophobicContact CG2-CB 4.15Å; I423-L474 HydrophobicContact CD1-CD1 3.66Å; I423-L630 HydrophobicContact CG1-CD1 3.81Å; I423-L630 HydrophobicContact CG1-CD2 3.93Å
424	K	98.6	Very high	98.5	Very high	89 Å²	89	33.4 Å²	33.4	39%	0.387	16%	0.158	S	C	.	.	H	α-helix	trans	-60.9	-41.8	179	-171.8	171.8	-179.8	173.5	0	112.4	L420 F421 F426 Q427 V428 L747	L420-K424 PolarHBondContact O-N 3.02Å; F421-K424 PolarHBondContact O-N 3.02Å; K424-F426 VanDerWaalsContact C-N 3.32Å; K424-F426 PolarHBondContact O-N 2.82Å; K424-Q427 PolarHBondContact O-N 2.95Å; K424-V428 HydrophobicContact CG-CG2 4.5Å; K424-V428 VanDerWaalsContact O-CG2 3.3Å; K424-V428 WeakPolarHBondContact O-CG2 3.24Å; K424-V428 PolarHBondContact O-N 3.46Å; K424-L747 WeakPolarHBondContact CE-O 3.34Å; K424-L747 HydrophobicContact CG-CD2 4.03Å; K424-L747 PolarHBondContact NZ-O 3.41Å
425	Q	98.4	Very high	98.5	Very high	63 Å²	63	32.3 Å²	32.3	29%	0.294	16%	0.155	S	C	.	.	H	α-helix	trans	-61.8	-38.1	176	-69.6	-170.6	-59.8	0	0	112.7	F421 R422 I423 S429 T634	F421-Q425 HydrophobicContact CD1-CG 4.44Å; F421-Q425 HydrophobicContact CE1-CG 4.08Å; F421-Q425 VanDerWaalsContact CE1-OE1 3.26Å; F421-Q425 HydrophobicContact CZ-CG 4.19Å; F421-Q425 WeakPolarHBondContact O-CG 3.44Å; F421-Q425 PolarHBondContact O-N 3.27Å; R422-Q425 VanDerWaalsContact CD-OE1 3.28Å; R422-Q425 PolarHBondContact O-N 2.76Å; I423-Q425 PolarHBondContact O-N 3.46Å; Q425-S429 PolarHBondContact O-N 2.74Å; Q425-S429 VanDerWaalsContact O-N 3.1Å; Q425-S429 PolarHBondContact O-OG 2.88Å; Q425-T634 HydrophobicContact CB-CG2 4.42Å
426	F	98.7	Very high	98.4	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-71.6	-43.7	176.5	-174.4	-147.5	0	0	0	112	R422 I423 K424 V428 S429 L430 L467 L540 I543 W547 L630 C633 T634 A637	R422-F426 PolarHBondContact O-N 2.73Å; I423-F426 PolarHBondContact O-N 2.78Å; I423-F426 VanDerWaalsContact O-N 3.15Å; K424-F426 VanDerWaalsContact C-N 3.32Å; K424-F426 PolarHBondContact O-N 2.82Å; F426-V428 VanDerWaalsContact C-N 3.35Å; F426-V428 PolarHBondContact O-N 2.95Å; F426-S429 PolarHBondContact O-N 3.16Å; F426-S429 VanDerWaalsContact O-N 3.14Å; F426-L430 HydrophobicContact CD1-CD1 4.47Å; F426-L430 HydrophobicContact CD2-CD1 4.26Å; F426-L430 HydrophobicContact CD2-CG 4.09Å; F426-L430 HydrophobicContact CE1-CD1 4.12Å; F426-L430 HydrophobicContact CE2-CD1 3.89Å; F426-L430 HydrophobicContact CE2-CD2 3.88Å; F426-L430 HydrophobicContact CE2-CG 3.71Å; F426-L430 HydrophobicContact CZ-CD1 3.8Å; F426-L430 HydrophobicContact CZ-CD2 4.16Å; F426-L430 HydrophobicContact CZ-CG 4.1Å; F426-L430 WeakPolarHBondContact O-CG 3.46Å; F426-L430 PolarHBondContact O-N 3.16Å; F426-L467 HydrophobicContact CD1-CD1 3.38Å; F426-L467 HydrophobicContact CD1-CD2 3.89Å; F426-L467 HydrophobicContact CD1-CG 4.26Å; F426-L467 HydrophobicContact CE1-CD1 3.7Å; F426-L467 HydrophobicContact CE1-CD2 4.26Å; F426-L467 HydrophobicContact CE1-CG 4.5Å; F426-L467 HydrophobicContact CG-CD1 4.12Å; F426-L540 HydrophobicContact CD1-CD2 3.97Å; F426-L540 HydrophobicContact CE1-CD2 3.59Å; F426-I543 HydrophobicContact CZ-CD1 4.04Å; F426-I543 HydrophobicContact CZ-CG2 4.27Å; F426-W547 HydrophobicContact CE2-CH2 4.2Å; F426-W547 HydrophobicContact CZ-CH2 4.44Å; F426-L630 HydrophobicContact CB-CD2 4.47Å; F426-L630 HydrophobicContact CD1-CD2 4.09Å; F426-C633 HydrophobicContact CD1-CB 4.14Å; F426-C633 HydrophobicContact CD2-CB 4Å; F426-C633 HydrophobicContact CE1-CB 3.75Å; F426-C633 HydrophobicContact CE2-CB 3.6Å; F426-C633 WeakPolarHBondContact CE2-O 3.38Å; F426-C633 HydrophobicContact CG-CB 4.28Å; F426-C633 HydrophobicContact CZ-CB 3.48Å; F426-C633 VanDerWaalsContact CZ-CB 3.48Å; F426-T634 WeakPolarHBondContact CA-OG1 3.29Å; F426-T634 WeakPolarHBondContact CB-OG1 3.14Å; F426-A637 HydrophobicContact CE2-CB 4.22Å
427	Q	98.8	Very high	98.3	Very high	5 Å²	5	39.9 Å²	39.9	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-55.3	-47.7	173.1	-72.5	175.5	-57.9	0	0	111.5	I423 K424 S429 L430 V431 V464 L467 E468 L747	I423-Q427 HydrophobicContact CG2-CG 4.26Å; I423-Q427 WeakPolarHBondContact O-CG 3.16Å; I423-Q427 PolarHBondContact O-N 3.4Å; K424-Q427 PolarHBondContact O-N 2.95Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; Q427-S429 PolarHBondContact O-N 3.34Å; Q427-L430 PolarHBondContact O-N 3.43Å; Q427-V431 WeakPolarHBondContact O-CG2 3.43Å; Q427-V431 PolarHBondContact O-N 3.06Å; Q427-V464 HydrophobicContact CB-CG1 4.09Å; Q427-V464 HydrophobicContact CG-CG1 3.99Å; Q427-V464 PolarHBondContact NE2-O 3.38Å; Q427-L467 HydrophobicContact CG-CB 3.81Å; Q427-L467 HydrophobicContact CG-CD1 3.88Å; Q427-E468 PolarHBondContact NE2-OE2 2.87Å; Q427-L747 HydrophobicContact CB-CD1 4.01Å; Q427-L747 HydrophobicContact CB-CD2 3.95Å
428	V	98.6	Very high	98.2	Very high	35 Å²	35	39.2 Å²	39.2	21%	0.212	19%	0.185	C	C	.	.	H	α-helix	trans	-57.9	-44.9	175.7	167.9	0	0	0	0	111.3	K424 F426 L430 V431 L432 L747 I749	K424-V428 HydrophobicContact CG-CG2 4.5Å; K424-V428 VanDerWaalsContact O-CG2 3.3Å; K424-V428 WeakPolarHBondContact O-CG2 3.24Å; K424-V428 PolarHBondContact O-N 3.46Å; F426-V428 VanDerWaalsContact C-N 3.35Å; F426-V428 PolarHBondContact O-N 2.95Å; V428-L430 VanDerWaalsContact C-N 3.34Å; V428-L430 PolarHBondContact O-N 3.09Å; V428-V431 PolarHBondContact O-N 3.34Å; V428-L432 HydrophobicContact CG1-CD1 3.87Å; V428-L432 HydrophobicContact CG1-CG 4.33Å; V428-L432 WeakPolarHBondContact O-CG 3.39Å; V428-L432 PolarHBondContact O-N 2.89Å; V428-L747 HydrophobicContact CG2-CB 4.01Å; V428-L747 HydrophobicContact CG2-CD1 4.14Å; V428-L747 HydrophobicContact CG2-CD2 4.46Å; V428-L747 HydrophobicContact CG2-CG 4.44Å; V428-I749 HydrophobicContact CB-CD1 4.28Å; V428-I749 HydrophobicContact CG1-CD1 4.05Å; V428-I749 HydrophobicContact CG1-CG1 4.18Å; V428-I749 HydrophobicContact CG2-CD1 4.08Å; V428-I749 HydrophobicContact CG2-CG1 4.11Å
429	S	98.5	Very high	98	Very high	7 Å²	7	39.4 Å²	39.4	5%	0.049	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-36.6	-179.5	-58	0	0	0	0	112.4	Q425 F426 Q427 L433 T634 Q638	Q425-S429 PolarHBondContact O-N 2.74Å; Q425-S429 VanDerWaalsContact O-N 3.1Å; Q425-S429 PolarHBondContact O-OG 2.88Å; F426-S429 PolarHBondContact O-N 3.16Å; F426-S429 VanDerWaalsContact O-N 3.14Å; Q427-S429 VanDerWaalsContact C-N 3.32Å; Q427-S429 PolarHBondContact O-N 3.34Å; S429-L433 VanDerWaalsContact O-CB 3.24Å; S429-L433 WeakPolarHBondContact O-CB 3.27Å; S429-L433 PolarHBondContact O-N 3.15Å; S429-T634 WeakPolarHBondContact OG-CG2 3.49Å; S429-Q638 PolarHBondContact OG-NE2 3.17Å
430	L	98.7	Very high	98	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67	-39.3	172.4	-70.1	170.4	0	0	0	112.5	F426 Q427 V428 L433 A434 L460 V464 L467 I543 W547	F426-L430 HydrophobicContact CD1-CD1 4.47Å; F426-L430 HydrophobicContact CD2-CD1 4.26Å; F426-L430 HydrophobicContact CD2-CG 4.09Å; F426-L430 HydrophobicContact CE1-CD1 4.12Å; F426-L430 HydrophobicContact CE2-CD1 3.89Å; F426-L430 HydrophobicContact CE2-CD2 3.88Å; F426-L430 HydrophobicContact CE2-CG 3.71Å; F426-L430 HydrophobicContact CZ-CD1 3.8Å; F426-L430 HydrophobicContact CZ-CD2 4.16Å; F426-L430 HydrophobicContact CZ-CG 4.1Å; F426-L430 WeakPolarHBondContact O-CG 3.46Å; F426-L430 PolarHBondContact O-N 3.16Å; Q427-L430 PolarHBondContact O-N 3.43Å; V428-L430 VanDerWaalsContact C-N 3.34Å; V428-L430 PolarHBondContact O-N 3.09Å; L430-L433 PolarHBondContact O-N 2.73Å; L430-A434 VanDerWaalsContact O-CB 3.28Å; L430-A434 WeakPolarHBondContact O-CB 3.29Å; L430-A434 PolarHBondContact O-N 2.85Å; L430-L460 HydrophobicContact CD2-CD2 4.17Å; L430-V464 HydrophobicContact CB-CG2 3.67Å; L430-V464 HydrophobicContact CD1-CG2 3.95Å; L430-V464 HydrophobicContact CG-CG2 4.49Å; L430-L467 HydrophobicContact CD1-CD1 3.8Å; L430-I543 HydrophobicContact CD2-CD1 3.9Å; L430-W547 HydrophobicContact CD2-CH2 4.18Å; L430-W547 HydrophobicContact CD2-CZ2 4.04Å
431	V	98.6	Very high	97.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-36.5	178.3	171.8	0	0	0	0	112.1	Q427 V428 S435 L461 V464 L740 W743 R744 L747 I749	Q427-V431 WeakPolarHBondContact O-CG2 3.43Å; Q427-V431 PolarHBondContact O-N 3.06Å; V428-V431 PolarHBondContact O-N 3.34Å; V431-S435 WeakPolarHBondContact O-CB 3.28Å; V431-S435 PolarHBondContact O-N 3.44Å; V431-S435 PolarHBondContact O-OG 3.24Å; V431-L461 HydrophobicContact CG2-CD2 3.86Å; V431-V464 HydrophobicContact CG2-CG1 4.4Å; V431-V464 HydrophobicContact CG2-CG2 4.04Å; V431-L740 HydrophobicContact CG1-CD1 3.99Å; V431-W743 HydrophobicContact CG2-CB 4.01Å; V431-R744 HydrophobicContact CG1-CG 3.86Å; V431-L747 HydrophobicContact CB-CD1 4.35Å; V431-L747 HydrophobicContact CG2-CD1 3.76Å; V431-I749 HydrophobicContact CB-CD1 3.86Å; V431-I749 HydrophobicContact CG1-CD1 3.58Å
432	L	97.9	Very high	97.8	Very high	77 Å²	77	35.2 Å²	35.2	40%	0.403	17%	0.173	S	C	.	.	H	α-helix	trans	-68	-41.8	172	-69	173.7	0	0	0	111.5	V428 S435 K436 I749	V428-L432 HydrophobicContact CG1-CD1 3.87Å; V428-L432 HydrophobicContact CG1-CG 4.33Å; V428-L432 WeakPolarHBondContact O-CG 3.39Å; V428-L432 PolarHBondContact O-N 2.89Å; L432-S435 WeakPolarHBondContact O-CB 3.49Å; L432-S435 PolarHBondContact O-N 3.38Å; L432-K436 PolarHBondContact O-N 2.85Å; L432-I749 HydrophobicContact CD2-CG2 3.97Å
433	L	97.9	Very high	97.7	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-40.6	174.5	-177.7	65.7	0	0	0	112.1	S429 L430 K436 Y437 L460 I640 F642	S429-L433 VanDerWaalsContact O-CB 3.24Å; S429-L433 WeakPolarHBondContact O-CB 3.27Å; S429-L433 PolarHBondContact O-N 3.15Å; L430-L433 PolarHBondContact O-N 2.73Å; L433-K436 PolarHBondContact O-N 3.43Å; L433-Y437 HydrophobicContact CD1-CD2 4.31Å; L433-Y437 HydrophobicContact CD1-CE2 4.17Å; L433-Y437 WeakPolarHBondContact O-CD2 3.36Å; L433-L460 HydrophobicContact CB-CD1 4.42Å; L433-L460 HydrophobicContact CD2-CD1 4.06Å; L433-L460 HydrophobicContact CD2-CD2 4.07Å; L433-L460 HydrophobicContact CG-CD1 3.92Å; L433-I640 HydrophobicContact CD1-CG1 4.22Å; L433-I640 HydrophobicContact CD2-CD1 3.67Å; L433-I640 HydrophobicContact CD2-CG1 4.12Å; L433-F642 HydrophobicContact CD1-CD2 4.4Å; L433-F642 HydrophobicContact CD1-CE2 3.85Å; L433-F642 HydrophobicContact CD2-CE2 3.87Å; L433-F642 HydrophobicContact CD2-CZ 4.25Å; L433-F642 HydrophobicContact CG-CE2 3.92Å
434	A	98.1	Very high	97.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-44.8	172.4	0	0	0	0	0	111.5	L430 K436 Y437 V438 P457 L460 L740	L430-A434 VanDerWaalsContact O-CB 3.28Å; L430-A434 WeakPolarHBondContact O-CB 3.29Å; L430-A434 PolarHBondContact O-N 2.85Å; A434-K436 VanDerWaalsContact C-N 3.27Å; A434-K436 PolarHBondContact O-N 3.23Å; A434-Y437 CarbonylContact O-C 3.58Å; A434-Y437 PolarHBondContact O-N 3.38Å; A434-V438 PolarHBondContact O-N 2.73Å; A434-P457 HydrophobicContact CB-CB 3.96Å; A434-P457 HydrophobicContact CB-CG 4.46Å; A434-L460 HydrophobicContact CB-CB 4.22Å; A434-L460 HydrophobicContact CB-CD1 4.07Å; A434-L740 HydrophobicContact CB-CD1 3.79Å
435	S	96.8	Very high	97.5	Very high	29 Å²	29	30.7 Å²	30.7	20%	0.203	16%	0.158	C	C	.	.	H	α-helix	trans	-57.8	-37.8	176.6	-62.2	0	0	0	0	112.9	V431 L432 Y437 R744	V431-S435 WeakPolarHBondContact O-CB 3.28Å; V431-S435 PolarHBondContact O-N 3.44Å; V431-S435 PolarHBondContact O-OG 3.24Å; L432-S435 WeakPolarHBondContact O-CB 3.49Å; L432-S435 PolarHBondContact O-N 3.38Å; S435-Y437 PolarHBondContact O-N 3.06Å; S435-R744 PolarHBondContact OG-NE 2.82Å; S435-R744 PolarHBondContact OG-NH2 3.5Å
436	K	96.4	Very high	97.4	Very high	125 Å²	125	31.5 Å²	31.5	54%	0.543	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.2	177.7	-178.8	179.8	171.5	-175.2	0	113.9	L432 L433 A434	L432-K436 PolarHBondContact O-N 2.85Å; L433-K436 PolarHBondContact O-N 3.43Å; A434-K436 VanDerWaalsContact C-N 3.27Å; A434-K436 PolarHBondContact O-N 3.23Å
437	Y	96.7	Very high	97.3	Very high	35 Å²	35	38.7 Å²	38.7	14%	0.137	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.2	36.5	-173.6	-68.3	-79.2	0	0	0	112.4	L433 A434 S435 D439 L440 L456 P457 F642	L433-Y437 HydrophobicContact CD1-CD2 4.31Å; L433-Y437 HydrophobicContact CD1-CE2 4.17Å; L433-Y437 WeakPolarHBondContact O-CD2 3.36Å; A434-Y437 CarbonylContact O-C 3.58Å; A434-Y437 PolarHBondContact O-N 3.38Å; S435-Y437 PolarHBondContact O-N 3.06Å; Y437-D439 VanDerWaalsContact C-N 3.31Å; Y437-D439 PolarHBondContact O-N 3.14Å; Y437-D439 VanDerWaalsContact O-N 3.14Å; Y437-L440 HydrophobicContact CD1-CB 4.46Å; Y437-L440 HydrophobicContact CD1-CD2 3.6Å; Y437-L440 HydrophobicContact CE1-CD2 4.23Å; Y437-L440 HydrophobicContact CG-CD2 4.21Å; Y437-L440 WeakPolarHBondContact O-CB 3.45Å; Y437-L440 PolarHBondContact O-N 2.89Å; Y437-L456 HydrophobicContact CG-CD2 4.31Å; Y437-P457 WeakPolarHBondContact O-CD 3.39Å; Y437-P457 WeakPolarHBondContact O-CG 3.34Å; Y437-F642 HydrophobicContact CD1-CB 4.45Å; Y437-F642 AromaticContact CD2-CD2 3.74Å; Y437-F642 HydrophobicContact CD2-CD2 3.74Å; Y437-F642 HydrophobicContact CD2-CE2 4.4Å; Y437-F642 HydrophobicContact CE1-CB 4.05Å; Y437-F642 HydrophobicContact CE2-CB 4.44Å; Y437-F642 AromaticContact CE2-CD2 3.62Å; Y437-F642 HydrophobicContact CE2-CD2 3.62Å; Y437-F642 HydrophobicContact CE2-CE2 4.45Å; Y437-F642 HydrophobicContact CG-CD2 4.3Å; Y437-F642 PolarHBondContact OH-N 3.01Å; Y437-F642 VanDerWaalsContact OH-N 3.08Å
438	V	96.1	Very high	97.1	Very high	45 Å²	45	42.6 Å²	42.6	27%	0.273	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-39.5	-169	66.5	0	0	0	0	115.1	A434 P457 L740	A434-V438 PolarHBondContact O-N 2.73Å; V438-P457 WeakPolarHBondContact O-CG 3.42Å; V438-L740 HydrophobicContact CG2-CD2 4.44Å
439	D	95.6	Very high	96.9	Very high	114 Å²	114	45.2 Å²	45.2	61%	0.61	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	7.9	-178.7	-52	-58.2	0	0	0	113.9	Y437 I441	Y437-D439 VanDerWaalsContact C-N 3.31Å; Y437-D439 PolarHBondContact O-N 3.14Å; Y437-D439 VanDerWaalsContact O-N 3.14Å; D439-I441 PolarHBondContact O-N 2.67Å; D439-I441 VanDerWaalsContact O-N 3.14Å
440	L	97.7	Very high	96.6	Very high	14 Å²	14	48.9 Å²	48.9	7%	0.073	24%	0.244	C	C	.	.			trans	-78.1	103.5	-174.2	-179.6	53	0	0	0	111.7	Y437 L456 F642 I647	Y437-L440 HydrophobicContact CD1-CB 4.46Å; Y437-L440 HydrophobicContact CD1-CD2 3.6Å; Y437-L440 HydrophobicContact CE1-CD2 4.23Å; Y437-L440 HydrophobicContact CG-CD2 4.21Å; Y437-L440 WeakPolarHBondContact O-CB 3.45Å; Y437-L440 PolarHBondContact O-N 2.89Å; L440-L456 HydrophobicContact CB-CB 4.4Å; L440-L456 HydrophobicContact CD2-CD2 3.81Å; L440-L456 HydrophobicContact CG-CB 4.47Å; L440-L456 HydrophobicContact CG-CD2 4.33Å; L440-L456 VanDerWaalsContact O-CB 3.3Å; L440-L456 WeakPolarHBondContact O-CB 3.43Å; L440-L456 PolarHBondContact O-N 3.29Å; L440-F642 HydrophobicContact CD2-CB 3.94Å; L440-I647 HydrophobicContact CD1-CG2 4.15Å; L440-I647 HydrophobicContact CD2-CD1 4.02Å
441	I	97.6	Very high	96.4	Very high	16 Å²	16	50.6 Å²	50.6	8%	0.082	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	131.4	171.6	-53.8	176.7	0	0	0	110.3	D439 P453 V454 L455 I647 L651 V718 E719 V722	D439-I441 PolarHBondContact O-N 2.67Å; D439-I441 VanDerWaalsContact O-N 3.14Å; I441-P453 HydrophobicContact CG2-CB 3.74Å; I441-V454 CarbonylContact C-O 3.58Å; I441-V454 WeakPolarHBondContact CA-O 3.46Å; I441-L455 HydrophobicContact CG1-CD2 3.96Å; I441-I647 WeakPolarHBondContact O-CG2 3.37Å; I441-L651 HydrophobicContact CB-CD1 4.11Å; I441-L651 HydrophobicContact CG2-CD1 4.04Å; I441-L651 HydrophobicContact CG2-CD2 4.04Å; I441-V718 HydrophobicContact CD1-CG2 4.39Å; I441-E719 HydrophobicContact CD1-CB 4.29Å; I441-E719 HydrophobicContact CD1-CG 3.92Å; I441-V722 HydrophobicContact CD1-CB 4.33Å; I441-V722 HydrophobicContact CD1-CG2 3.93Å; I441-V722 HydrophobicContact CG1-CG2 4.11Å; I441-V722 HydrophobicContact CG2-CG2 4.12Å
442	V	97.3	Very high	96.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	156.2	170.3	-69.3	0	0	0	0	109.9	G444 V454 L456 W550 I647	V442-G444 PolarHBondContact O-N 3.11Å; V442-V454 HydrophobicContact CG2-CG2 3.72Å; V442-V454 WeakPolarHBondContact CG2-O 3.26Å; V442-V454 PolarHBondContact N-O 3.06Å; V442-V454 PolarHBondContact O-N 3.15Å; V442-V454 VanDerWaalsContact O-O 3.1Å; V442-L456 HydrophobicContact CG1-CB 4.02Å; V442-L456 HydrophobicContact CG1-CD1 4.44Å; V442-L456 HydrophobicContact CG2-CB 4.2Å; V442-W550 HydrophobicContact CB-CH2 4.44Å; V442-W550 HydrophobicContact CG1-CH2 4.23Å; V442-W550 HydrophobicContact CG1-CZ3 4.41Å; V442-W550 HydrophobicContact CG2-CH2 4.29Å; V442-I647 HydrophobicContact CB-CG2 4.36Å; V442-I647 HydrophobicContact CG1-CD1 4.1Å; V442-I647 HydrophobicContact CG1-CG1 4.48Å; V442-I647 HydrophobicContact CG1-CG2 3.72Å
443	P	96.6	Very high	96.1	Very high	2 Å²	2	50 Å²	50	1%	0.013	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.2	166.8	27.7	-31.1	0	0	0	109.5	Y445 R450 F557 L651 L656	P443-Y445 HydrophobicContact CB-CE2 4.22Å; P443-Y445 HydrophobicContact CG-CE2 3.85Å; P443-Y445 WeakPolarHBondContact O-CD2 3.38Å; P443-Y445 WeakPolarHBondContact O-CE2 3.23Å; P443-R450 HydrophobicContact CB-CG 4.09Å; P443-F557 HydrophobicContact CG-CE2 3.75Å; P443-F557 HydrophobicContact CG-CZ 3.78Å; P443-L651 HydrophobicContact CB-CD2 4.47Å; P443-L656 HydrophobicContact CB-CD1 4.29Å
444	G	96.2	Very high	96.1	Very high	14 Å²	14	50.9 Å²	50.9	14%	0.144	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	145	167.7	0	0	0	0	0	110.9	V442 A451 Q452	V442-G444 PolarHBondContact O-N 3.11Å; G444-A451 PolarHBondContact O-N 3.48Å; G444-Q452 WeakPolarHBondContact CA-O 3.26Å; G444-Q452 PolarHBondContact N-O 3.36Å
445	Y	96.3	Very high	96.1	Very high	53 Å²	53	51.1 Å²	51.1	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.4	-171.1	-71.3	-89.1	0	0	0	113.7	P443 L448 Q449 R450 F555 F557	P443-Y445 HydrophobicContact CB-CE2 4.22Å; P443-Y445 HydrophobicContact CG-CE2 3.85Å; P443-Y445 WeakPolarHBondContact O-CD2 3.38Å; P443-Y445 WeakPolarHBondContact O-CE2 3.23Å; Y445-L448 HydrophobicContact CD1-CD1 4.27Å; Y445-Q449 VanDerWaalsContact CA-O 3.27Å; Y445-Q449 WeakPolarHBondContact CA-O 3.37Å; Y445-Q449 WeakPolarHBondContact CD1-O 3.34Å; Y445-R450 HydrophobicContact CD1-CG 4.34Å; Y445-R450 HydrophobicContact CE1-CG 3.75Å; Y445-F555 HydrophobicContact CE1-CE1 4.17Å; Y445-F555 HydrophobicContact CE2-CE1 4.17Å; Y445-F555 AromaticContact CZ-CE1 3.67Å; Y445-F555 WeakPolarHBondContact OH-CE1 3.27Å; Y445-F557 HydrophobicContact CE2-CE2 4.22Å; Y445-F557 WeakPolarHBondContact OH-CE2 3.48Å
446	T	96.1	Very high	96.2	Very high	81 Å²	81	49.8 Å²	49.8	50%	0.497	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.8	163	61	0	0	0	0	108.5	L448 Q449 A451	T446-L448 PolarHBondContact O-N 3.41Å; T446-L448 VanDerWaalsContact O-N 3.09Å; T446-Q449 PolarHBondContact N-O 2.95Å; T446-Q449 WeakPolarHBondContact O-CA 3.48Å; T446-Q449 WeakPolarHBondContact O-CB 3.2Å; T446-Q449 PolarHBondContact O-N 3.12Å; T446-Q449 VanDerWaalsContact O-O 3.09Å; T446-A451 HydrophobicContact CG2-CB 4.31Å
447	H	96.2	Very high	96.3	Very high	153 Å²	153	43.8 Å²	43.8	71%	0.708	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	26.8	-171.4	-46.9	-87.4	0	0	0	114.3	Q449	H447-Q449 PolarHBondContact O-N 2.85Å; H447-Q449 VanDerWaalsContact O-N 3.09Å
448	L	95.2	Very high	96.3	Very high	86 Å²	86	44.3 Å²	44.3	45%	0.45	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	14.5	-168	-154.9	62.8	0	0	0	114.6	Y445 T446 L549 F555	Y445-L448 HydrophobicContact CD1-CD1 4.27Å; T446-L448 PolarHBondContact O-N 3.41Å; T446-L448 VanDerWaalsContact O-N 3.09Å; L448-L549 HydrophobicContact CD1-CD1 4.17Å; L448-L549 HydrophobicContact CD2-CD1 4.46Å; L448-F555 HydrophobicContact CD1-CZ 4.03Å; L448-F555 HydrophobicContact CG-CZ 4.41Å
449	Q	93.8	Very high	96.4	Very high	90 Å²	90	44.3 Å²	44.3	42%	0.421	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	151.7	162.8	-60.3	-50.9	-64.4	0	0	109.9	V84 Y445 T446 H447	V84-Q449 HydrophobicContact CG1-CG 3.72Å; Y445-Q449 VanDerWaalsContact CA-O 3.27Å; Y445-Q449 WeakPolarHBondContact CA-O 3.37Å; Y445-Q449 WeakPolarHBondContact CD1-O 3.34Å; T446-Q449 PolarHBondContact N-O 2.95Å; T446-Q449 WeakPolarHBondContact O-CA 3.48Å; T446-Q449 WeakPolarHBondContact O-CB 3.2Å; T446-Q449 PolarHBondContact O-N 3.12Å; T446-Q449 VanDerWaalsContact O-O 3.09Å; H447-Q449 PolarHBondContact O-N 2.85Å; H447-Q449 VanDerWaalsContact O-N 3.09Å
450	R	93.7	Very high	96.6	Very high	85 Å²	85	39 Å²	39	32%	0.321	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.6	176.6	-63.2	179.4	-178.1	175.4	-1.1	109.3	P443 Y445 S650 A653 L656	P443-R450 HydrophobicContact CB-CG 4.09Å; Y445-R450 HydrophobicContact CD1-CG 4.34Å; Y445-R450 HydrophobicContact CE1-CG 3.75Å; R450-S650 PolarHBondContact NH1-O 3.29Å; R450-A653 VanDerWaalsContact CD-O 3.24Å; R450-A653 WeakPolarHBondContact CD-O 3.43Å; R450-A653 PolarHBondContact NH1-O 3.17Å; R450-L656 HydrophobicContact CB-CD2 4Å
451	A	93.2	Very high	96.6	Very high	35 Å²	35	38.3 Å²	38.3	29%	0.289	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-69.9	-176.1	0	0	0	0	0	112	G444 T446	G444-A451 PolarHBondContact O-N 3.48Å; T446-A451 HydrophobicContact CG2-CB 4.31Å
452	Q	94.9	Very high	96.7	Very high	65 Å²	65	39.6 Å²	39.6	30%	0.304	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	156.8	-173.3	-69.8	-179.5	-31.5	0	0	109.8	G444 T659 F725	G444-Q452 WeakPolarHBondContact CA-O 3.26Å; G444-Q452 PolarHBondContact N-O 3.36Å; Q452-T659 VanDerWaalsContact NE2-CB 3.3Å; Q452-T659 PolarHBondContact NE2-OG1 3.23Å; Q452-F725 HydrophobicContact CB-CZ 4.46Å; Q452-F725 HydrophobicContact CG-CZ 4.49Å
453	P	96.2	Very high	96.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	132.3	174.2	31.5	-24.3	0	0	0	108.7	I441 L656 V718 A721 V722	I441-P453 HydrophobicContact CG2-CB 3.74Å; P453-L656 HydrophobicContact CB-CB 4.32Å; P453-L656 HydrophobicContact CB-CD1 4.2Å; P453-L656 WeakPolarHBondContact CD-O 3.37Å; P453-L656 HydrophobicContact CG-CB 4.18Å; P453-V718 HydrophobicContact CB-CB 3.93Å; P453-V718 HydrophobicContact CB-CG1 4.14Å; P453-V718 HydrophobicContact CG-CB 4.28Å; P453-V718 HydrophobicContact CG-CG1 4.41Å; P453-A721 HydrophobicContact CG-CB 3.65Å; P453-V722 HydrophobicContact CB-CG2 3.97Å; P453-V722 HydrophobicContact CG-CG2 4.13Å
454	V	97.4	Very high	96.8	Very high	25 Å²	25	40.1 Å²	40.1	15%	0.152	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	148.2	178.4	-58.9	0	0	0	0	110.8	I441 V442 L456 T731	I441-V454 CarbonylContact C-O 3.58Å; I441-V454 WeakPolarHBondContact CA-O 3.46Å; V442-V454 HydrophobicContact CG2-CG2 3.72Å; V442-V454 WeakPolarHBondContact CG2-O 3.26Å; V442-V454 PolarHBondContact N-O 3.06Å; V442-V454 PolarHBondContact O-N 3.15Å; V442-V454 VanDerWaalsContact O-O 3.1Å; V454-L456 PolarHBondContact O-N 3.01Å; V454-T731 VanDerWaalsContact CA-OG1 3.31Å; V454-T731 WeakPolarHBondContact CA-OG1 3.48Å; V454-T731 HydrophobicContact CB-CG2 4.23Å; V454-T731 WeakPolarHBondContact CB-OG1 3.43Å; V454-T731 HydrophobicContact CG1-CG2 4.06Å
455	L	98.1	Very high	96.9	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	129.3	167.8	-72.1	177	0	0	0	109.9	I441 P457 H458 L459 V722 T731 V736	I441-L455 HydrophobicContact CG1-CD2 3.96Å; L455-P457 VanDerWaalsContact C-N 3.33Å; L455-H458 HydrophobicContact CB-CB 4.49Å; L455-H458 WeakPolarHBondContact O-CA 3.32Å; L455-H458 WeakPolarHBondContact O-CB 3.46Å; L455-H458 PolarHBondContact O-N 3.02Å; L455-L459 PolarHBondContact O-N 3.23Å; L455-V722 HydrophobicContact CD1-CG1 4.22Å; L455-V722 HydrophobicContact CD2-CG1 4.34Å; L455-V722 HydrophobicContact CG-CG1 3.91Å; L455-T731 WeakPolarHBondContact CD1-O 3.32Å; L455-T731 PolarHBondContact N-OG1 3.32Å; L455-V736 HydrophobicContact CB-CG1 4.34Å; L455-V736 HydrophobicContact CB-CG2 4.47Å; L455-V736 HydrophobicContact CD1-CB 3.97Å; L455-V736 HydrophobicContact CD1-CG1 4.05Å; L455-V736 HydrophobicContact CD1-CG2 4.1Å
456	L	98.3	Very high	97.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-51.5	-43.2	174.8	170.7	64.6	0	0	0	113.3	Y437 L440 V442 V454 H458 L459 L460 W550 F642	Y437-L456 HydrophobicContact CG-CD2 4.31Å; L440-L456 HydrophobicContact CB-CB 4.4Å; L440-L456 HydrophobicContact CD2-CD2 3.81Å; L440-L456 HydrophobicContact CG-CB 4.47Å; L440-L456 HydrophobicContact CG-CD2 4.33Å; L440-L456 VanDerWaalsContact O-CB 3.3Å; L440-L456 WeakPolarHBondContact O-CB 3.43Å; L440-L456 PolarHBondContact O-N 3.29Å; V442-L456 HydrophobicContact CG1-CB 4.02Å; V442-L456 HydrophobicContact CG1-CD1 4.44Å; V442-L456 HydrophobicContact CG2-CB 4.2Å; V454-L456 PolarHBondContact O-N 3.01Å; L456-H458 PolarHBondContact O-N 3.42Å; L456-L459 PolarHBondContact O-N 2.91Å; L456-L459 VanDerWaalsContact O-N 3.09Å; L456-L460 HydrophobicContact CD1-CD1 4.2Å; L456-L460 HydrophobicContact CD1-CG 4.07Å; L456-L460 HydrophobicContact CG-CD1 3.99Å; L456-L460 HydrophobicContact CG-CG 4.33Å; L456-L460 PolarHBondContact O-N 3.18Å; L456-W550 HydrophobicContact CD1-CH2 3.81Å; L456-W550 HydrophobicContact CD1-CZ3 3.69Å; L456-F642 HydrophobicContact CD1-CE1 4.18Å; L456-F642 HydrophobicContact CD1-CE2 4.5Å; L456-F642 HydrophobicContact CD1-CZ 4.13Å; L456-F642 HydrophobicContact CD2-CB 4.23Å; L456-F642 HydrophobicContact CD2-CD1 4.03Å; L456-F642 HydrophobicContact CD2-CD2 3.48Å; L456-F642 VanDerWaalsContact CD2-CD2 3.48Å; L456-F642 HydrophobicContact CD2-CE1 4.24Å; L456-F642 HydrophobicContact CD2-CE2 3.71Å; L456-F642 HydrophobicContact CD2-CG 3.64Å; L456-F642 HydrophobicContact CD2-CZ 4.1Å
457	P	98.4	Very high	97.2	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-49.6	-39.8	170.3	-30.8	33.3	0	0	0	114.2	A434 Y437 V438 L455 L459 L460 L461 V736	A434-P457 HydrophobicContact CB-CB 3.96Å; A434-P457 HydrophobicContact CB-CG 4.46Å; Y437-P457 WeakPolarHBondContact O-CD 3.39Å; Y437-P457 WeakPolarHBondContact O-CG 3.34Å; V438-P457 WeakPolarHBondContact O-CG 3.42Å; L455-P457 VanDerWaalsContact C-N 3.33Å; P457-L459 VanDerWaalsContact C-N 3.34Å; P457-L459 PolarHBondContact O-N 3.23Å; P457-L460 PolarHBondContact O-N 3.03Å; P457-L461 WeakPolarHBondContact O-CB 2.99Å; P457-L461 VanDerWaalsContact O-CG 3.23Å; P457-L461 WeakPolarHBondContact O-CG 3.24Å; P457-L461 PolarHBondContact O-N 3.49Å; P457-V736 HydrophobicContact CB-CG1 3.67Å; P457-V736 HydrophobicContact CG-CG1 4.48Å
458	H	98.4	Very high	97.3	Very high	45 Å²	45	31.2 Å²	31.2	21%	0.208	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-39.9	179.7	-169.9	55.2	0	0	0	111.8	L455 L456 S462 G729 T731 V736	L455-H458 HydrophobicContact CB-CB 4.49Å; L455-H458 WeakPolarHBondContact O-CA 3.32Å; L455-H458 WeakPolarHBondContact O-CB 3.46Å; L455-H458 PolarHBondContact O-N 3.02Å; L456-H458 PolarHBondContact O-N 3.42Å; H458-S462 PolarHBondContact O-N 3.43Å; H458-S462 VanDerWaalsContact O-N 3.1Å; H458-G729 PolarHBondContact CE1-O 3.15Å; H458-G729 VanDerWaalsContact CE1-O 3.25Å; H458-T731 VanDerWaalsContact CD2-CB 3.43Å; H458-T731 WeakPolarHBondContact CD2-CB 3.15Å; H458-T731 PolarHBondContact CD2-OG1 3.45Å; H458-V736 HydrophobicContact CB-CG2 3.81Å
459	L	97.8	Very high	97.5	Very high	46 Å²	46	32.5 Å²	32.5	24%	0.241	16%	0.157	C	C	.	.	H	α-helix	trans	-66.9	-43.8	173.6	-175.5	67.7	0	0	0	111.6	L455 L456 P457 S462 Y463 W550	L455-L459 PolarHBondContact O-N 3.23Å; L456-L459 PolarHBondContact O-N 2.91Å; L456-L459 VanDerWaalsContact O-N 3.09Å; P457-L459 VanDerWaalsContact C-N 3.34Å; P457-L459 PolarHBondContact O-N 3.23Å; L459-S462 WeakPolarHBondContact O-CB 3.45Å; L459-S462 PolarHBondContact O-N 2.96Å; L459-S462 PolarHBondContact O-OG 3.06Å; L459-Y463 HydrophobicContact CG-CE2 4.24Å; L459-Y463 VanDerWaalsContact O-CD2 3.26Å; L459-Y463 WeakPolarHBondContact O-CD2 3.36Å; L459-W550 HydrophobicContact CD2-CH2 3.5Å; L459-W550 HydrophobicContact CD2-CZ2 3.49Å; L459-W550 VanDerWaalsContact CD2-CZ2 3.49Å
460	L	98.5	Very high	97.7	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-44.6	178.4	-68.7	173.3	0	0	0	111.9	L430 L433 A434 L456 P457 S462 Y463 V464 F642	L430-L460 HydrophobicContact CD2-CD2 4.17Å; L433-L460 HydrophobicContact CB-CD1 4.42Å; L433-L460 HydrophobicContact CD2-CD1 4.06Å; L433-L460 HydrophobicContact CD2-CD2 4.07Å; L433-L460 HydrophobicContact CG-CD1 3.92Å; A434-L460 HydrophobicContact CB-CB 4.22Å; A434-L460 HydrophobicContact CB-CD1 4.07Å; L456-L460 HydrophobicContact CD1-CD1 4.2Å; L456-L460 HydrophobicContact CD1-CG 4.07Å; L456-L460 HydrophobicContact CG-CD1 3.99Å; L456-L460 HydrophobicContact CG-CG 4.33Å; L456-L460 PolarHBondContact O-N 3.18Å; P457-L460 PolarHBondContact O-N 3.03Å; L460-S462 PolarHBondContact O-N 2.82Å; L460-Y463 PolarHBondContact O-N 3.02Å; L460-Y463 VanDerWaalsContact O-N 3.09Å; L460-V464 PolarHBondContact O-N 3.4Å; L460-F642 HydrophobicContact CD1-CE2 4.47Å
461	L	98.6	Very high	98	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-30.6	174.8	-67.4	177.6	0	0	0	111.7	V431 P457 Y463 V464 E465 Q739 L740 W743	V431-L461 HydrophobicContact CG2-CD2 3.86Å; P457-L461 WeakPolarHBondContact O-CB 2.99Å; P457-L461 VanDerWaalsContact O-CG 3.23Å; P457-L461 WeakPolarHBondContact O-CG 3.24Å; P457-L461 PolarHBondContact O-N 3.49Å; L461-Y463 PolarHBondContact O-N 2.99Å; L461-Y463 VanDerWaalsContact O-N 3.11Å; L461-V464 HydrophobicContact CD2-CG2 4.14Å; L461-V464 WeakPolarHBondContact O-CA 3.3Å; L461-V464 WeakPolarHBondContact O-CB 3.41Å; L461-V464 PolarHBondContact O-N 3.39Å; L461-E465 VanDerWaalsContact O-CG 3.26Å; L461-E465 WeakPolarHBondContact O-CG 3.47Å; L461-E465 PolarHBondContact O-N 2.63Å; L461-Q739 HydrophobicContact CD1-CB 3.95Å; L461-Q739 HydrophobicContact CD1-CG 3.93Å; L461-L740 HydrophobicContact CD1-CB 4.32Å; L461-L740 HydrophobicContact CD1-CD1 4.38Å; L461-L740 HydrophobicContact CD2-CD1 4.31Å; L461-W743 HydrophobicContact CD2-CB 4.38Å; L461-W743 HydrophobicContact CD2-CG 4.18Å
462	S	98.5	Very high	98.2	Very high	43 Å²	43	24.3 Å²	24.3	30%	0.301	13%	0.125	S	C	.	.	H	α-helix	trans	-59.7	-23.2	173.8	87.7	0	0	0	0	114	H458 L459 L460 Q466	H458-S462 PolarHBondContact O-N 3.43Å; H458-S462 VanDerWaalsContact O-N 3.1Å; L459-S462 WeakPolarHBondContact O-CB 3.45Å; L459-S462 PolarHBondContact O-N 2.96Å; L459-S462 PolarHBondContact O-OG 3.06Å; L460-S462 PolarHBondContact O-N 2.82Å; S462-Q466 WeakPolarHBondContact O-CG 3.3Å; S462-Q466 PolarHBondContact O-N 3.49Å; S462-Q466 PolarHBondContact O-NE2 3.37Å
463	Y	98.7	Very high	98.4	Very high	13 Å²	13	25.1 Å²	25.1	5%	0.051	13%	0.125	C	C	.	.	H	α-helix	trans	-84.4	-34.2	171	-60.3	-78.3	0	0	0	112.4	L459 L460 L461 E465 Q466 L467 R542 I543 E546	L459-Y463 HydrophobicContact CG-CE2 4.24Å; L459-Y463 VanDerWaalsContact O-CD2 3.26Å; L459-Y463 WeakPolarHBondContact O-CD2 3.36Å; L460-Y463 PolarHBondContact O-N 3.02Å; L460-Y463 VanDerWaalsContact O-N 3.09Å; L461-Y463 PolarHBondContact O-N 2.99Å; L461-Y463 VanDerWaalsContact O-N 3.11Å; Y463-E465 VanDerWaalsContact C-N 3.28Å; Y463-E465 PolarHBondContact O-N 3.17Å; Y463-Q466 WeakPolarHBondContact O-CB 3.4Å; Y463-Q466 PolarHBondContact O-N 3.48Å; Y463-Q466 VanDerWaalsContact O-N 3.09Å; Y463-L467 VanDerWaalsContact O-CG 3.29Å; Y463-L467 WeakPolarHBondContact O-CG 3.44Å; Y463-L467 PolarHBondContact O-N 3.47Å; Y463-R542 HydrophobicContact CE1-CB 4.4Å; Y463-I543 HydrophobicContact CD1-CB 3.76Å; Y463-I543 HydrophobicContact CD1-CD1 4.09Å; Y463-I543 HydrophobicContact CD1-CG1 4.12Å; Y463-I543 HydrophobicContact CD2-CD1 3.67Å; Y463-I543 HydrophobicContact CD2-CG1 4.11Å; Y463-I543 HydrophobicContact CE1-CB 3.54Å; Y463-I543 HydrophobicContact CE1-CD1 4.35Å; Y463-I543 HydrophobicContact CE1-CG1 3.91Å; Y463-I543 HydrophobicContact CE2-CB 4.46Å; Y463-I543 HydrophobicContact CE2-CD1 3.95Å; Y463-I543 HydrophobicContact CE2-CG1 3.9Å; Y463-I543 HydrophobicContact CG-CB 4.31Å; Y463-I543 HydrophobicContact CG-CD1 3.73Å; Y463-I543 HydrophobicContact CG-CG1 4.21Å; Y463-E546 WeakPolarHBondContact OH-CB 3.35Å
464	V	98.8	Very high	98.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-43.2	171.1	-177	0	0	0	0	110.6	Q427 L430 V431 L460 L461 Q466 L467 E468 W743	Q427-V464 HydrophobicContact CB-CG1 4.09Å; Q427-V464 HydrophobicContact CG-CG1 3.99Å; Q427-V464 PolarHBondContact NE2-O 3.38Å; L430-V464 HydrophobicContact CB-CG2 3.67Å; L430-V464 HydrophobicContact CD1-CG2 3.95Å; L430-V464 HydrophobicContact CG-CG2 4.49Å; V431-V464 HydrophobicContact CG2-CG1 4.4Å; V431-V464 HydrophobicContact CG2-CG2 4.04Å; L460-V464 PolarHBondContact O-N 3.4Å; L461-V464 HydrophobicContact CD2-CG2 4.14Å; L461-V464 WeakPolarHBondContact O-CA 3.3Å; L461-V464 WeakPolarHBondContact O-CB 3.41Å; L461-V464 PolarHBondContact O-N 3.39Å; V464-Q466 VanDerWaalsContact C-N 3.34Å; V464-Q466 PolarHBondContact O-N 3.37Å; V464-L467 PolarHBondContact O-N 3.11Å; V464-E468 PolarHBondContact O-N 3.18Å; V464-W743 HydrophobicContact CG1-CD2 3.51Å; V464-W743 HydrophobicContact CG1-CE3 3.54Å; V464-W743 HydrophobicContact CG1-CG 4.18Å; V464-W743 HydrophobicContact CG1-CH2 3.95Å; V464-W743 HydrophobicContact CG1-CZ2 3.91Å; V464-W743 HydrophobicContact CG1-CZ3 3.75Å
465	E	98.7	Very high	98.6	Very high	60 Å²	60	25.9 Å²	25.9	28%	0.28	13%	0.129	S	C	.	.	H	α-helix	trans	-60.9	-37	172.9	-65.1	-75.1	164.4	0	0	113.1	L461 Y463 R469 Q739 W743	L461-E465 VanDerWaalsContact O-CG 3.26Å; L461-E465 WeakPolarHBondContact O-CG 3.47Å; L461-E465 PolarHBondContact O-N 2.63Å; Y463-E465 VanDerWaalsContact C-N 3.28Å; Y463-E465 PolarHBondContact O-N 3.17Å; E465-R469 PolarHBondContact O-NE 2.99Å; E465-R469 PolarHBondContact O-NH1 2.9Å; E465-R469 PolarHBondContact O-NH2 3.37Å; E465-R469 IonicContact OE2-NH1 3.83Å; E465-Q739 PolarHBondContact OE1-NE2 3.11Å; E465-W743 HydrophobicContact CG-CZ2 4.47Å; E465-W743 PolarHBondContact OE1-NE1 2.95Å; E465-W743 VanDerWaalsContact OE1-NE1 3.11Å
466	Q	98.8	Very high	98.6	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-68.1	-48.6	176.5	-80	167.1	96.9	0	0	110.7	S462 Y463 V464 E468 R469 D470 H539	S462-Q466 WeakPolarHBondContact O-CG 3.3Å; S462-Q466 PolarHBondContact O-N 3.49Å; S462-Q466 PolarHBondContact O-NE2 3.37Å; Y463-Q466 WeakPolarHBondContact O-CB 3.4Å; Y463-Q466 PolarHBondContact O-N 3.48Å; Y463-Q466 VanDerWaalsContact O-N 3.09Å; V464-Q466 VanDerWaalsContact C-N 3.34Å; V464-Q466 PolarHBondContact O-N 3.37Å; Q466-E468 VanDerWaalsContact C-N 3.34Å; Q466-E468 PolarHBondContact O-N 3.4Å; Q466-R469 PolarHBondContact O-N 3.32Å; Q466-D470 VanDerWaalsContact O-CG 3.3Å; Q466-D470 PolarHBondContact O-N 3.34Å; Q466-H539 HydrophobicContact CB-CB 4.11Å; Q466-H539 PolarHBondContact OE1-CD2 3.07Å
467	L	98.8	Very high	98.6	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-38.4	178.2	-70.5	165.7	0	0	0	112.8	I423 F426 Q427 L430 Y463 V464 R469 D470 A471 L540 L630	I423-L467 HydrophobicContact CG2-CB 4.02Å; F426-L467 HydrophobicContact CD1-CD1 3.38Å; F426-L467 HydrophobicContact CD1-CD2 3.89Å; F426-L467 HydrophobicContact CD1-CG 4.26Å; F426-L467 HydrophobicContact CE1-CD1 3.7Å; F426-L467 HydrophobicContact CE1-CD2 4.26Å; F426-L467 HydrophobicContact CE1-CG 4.5Å; F426-L467 HydrophobicContact CG-CD1 4.12Å; Q427-L467 HydrophobicContact CG-CB 3.81Å; Q427-L467 HydrophobicContact CG-CD1 3.88Å; L430-L467 HydrophobicContact CD1-CD1 3.8Å; Y463-L467 VanDerWaalsContact O-CG 3.29Å; Y463-L467 WeakPolarHBondContact O-CG 3.44Å; Y463-L467 PolarHBondContact O-N 3.47Å; V464-L467 PolarHBondContact O-N 3.11Å; L467-R469 VanDerWaalsContact C-N 3.33Å; L467-R469 PolarHBondContact O-N 2.89Å; L467-D470 WeakPolarHBondContact O-CA 3.31Å; L467-D470 WeakPolarHBondContact O-CB 3.29Å; L467-D470 PolarHBondContact O-N 3.16Å; L467-A471 PolarHBondContact O-N 3.38Å; L467-L540 HydrophobicContact CD2-CD2 4.38Å; L467-L630 HydrophobicContact CD2-CD2 4.15Å
468	E	98.7	Very high	98.6	Very high	41 Å²	41	33 Å²	33	19%	0.192	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-41.3	176.9	-172	66.9	-168.3	0	0	112	Q427 V464 Q466 D470 A471 G472 W743 Q746	Q427-E468 PolarHBondContact NE2-OE2 2.87Å; V464-E468 PolarHBondContact O-N 3.18Å; Q466-E468 VanDerWaalsContact C-N 3.34Å; Q466-E468 PolarHBondContact O-N 3.4Å; E468-D470 PolarHBondContact O-N 3.49Å; E468-A471 PolarHBondContact O-N 3.28Å; E468-G472 PolarHBondContact O-N 3.41Å; E468-W743 HydrophobicContact CB-CH2 3.71Å; E468-W743 HydrophobicContact CB-CZ2 4.47Å; E468-W743 HydrophobicContact CG-CH2 3.74Å; E468-Q746 VanDerWaalsContact CD-NE2 3.32Å; E468-Q746 PolarHBondContact OE1-NE2 3.49Å
469	R	98.9	Very high	98.6	Very high	112 Å²	112	36.6 Å²	36.6	42%	0.423	18%	0.179	S	C	.	.	H	α-helix	trans	-65.9	-30.6	175.2	-69.4	-177.5	-71	-86.1	2.8	111.4	E465 Q466 L467 R473	E465-R469 PolarHBondContact O-NE 2.99Å; E465-R469 PolarHBondContact O-NH1 2.9Å; E465-R469 PolarHBondContact O-NH2 3.37Å; E465-R469 IonicContact OE2-NH1 3.83Å; Q466-R469 PolarHBondContact O-N 3.32Å; L467-R469 VanDerWaalsContact C-N 3.33Å; L467-R469 PolarHBondContact O-N 2.89Å; R469-R473 WeakPolarHBondContact O-CG 3.38Å; R469-R473 PolarHBondContact O-N 3.38Å; R469-R473 PolarHBondContact O-NH1 3.13Å
470	D	98.9	Very high	98.6	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-72.3	-45	176.7	-56.1	-25	0	0	0	110.9	I423 Q466 L467 E468 G472 R473 L474 A536 H539	I423-D470 HydrophobicContact CD1-CB 4.39Å; Q466-D470 VanDerWaalsContact O-CG 3.3Å; Q466-D470 PolarHBondContact O-N 3.34Å; L467-D470 WeakPolarHBondContact O-CA 3.31Å; L467-D470 WeakPolarHBondContact O-CB 3.29Å; L467-D470 PolarHBondContact O-N 3.16Å; E468-D470 PolarHBondContact O-N 3.49Å; D470-G472 VanDerWaalsContact C-N 3.34Å; D470-G472 PolarHBondContact O-N 3.08Å; D470-R473 PolarHBondContact O-N 3.13Å; D470-R473 VanDerWaalsContact O-N 3.16Å; D470-R473 IonicContact OD1-CZ 2.68Å; D470-R473 IonicContact OD1-NH1 3.32Å; D470-R473 PolarHBondContact OD1-NH1 3.14Å; D470-L474 WeakPolarHBondContact O-CG 3.39Å; D470-L474 PolarHBondContact O-N 2.96Å; D470-A536 HydrophobicContact CB-CB 4.12Å; D470-A536 WeakPolarHBondContact OD2-CA 3.43Å; D470-H539 VanDerWaalsContact CG-ND1 3.25Å; D470-H539 IonicContact OD1-CE1 2.73Å; D470-H539 PolarHBondContact OD1-CE1 3.37Å; D470-H539 IonicContact OD1-ND1 4Å; D470-H539 PolarHBondContact OD1-ND1 2.82Å; D470-H539 IonicContact OD2-CE1 2.75Å; D470-H539 IonicContact OD2-CG 3.79Å; D470-H539 IonicContact OD2-ND1 2.68Å; D470-H539 PolarHBondContact OD2-ND1 2.58Å
471	A	98.8	Very high	98.6	Very high	13 Å²	13	40.4 Å²	40.4	11%	0.107	19%	0.19	C	C	.	.	H	α-helix	trans	-56.3	-46.7	170	0	0	0	0	0	111.7	L420 I423 L467 E468 R473 L474 V475	L420-A471 HydrophobicContact CD2-CB 3.65Å; I423-A471 HydrophobicContact CD1-CB 4.42Å; I423-A471 HydrophobicContact CG2-CB 4.15Å; L467-A471 PolarHBondContact O-N 3.38Å; E468-A471 PolarHBondContact O-N 3.28Å; A471-R473 VanDerWaalsContact C-N 3.32Å; A471-R473 PolarHBondContact O-N 2.94Å; A471-L474 PolarHBondContact O-N 3.1Å; A471-L474 VanDerWaalsContact O-N 3.13Å; A471-V475 WeakPolarHBondContact O-CG2 3.41Å; A471-V475 PolarHBondContact O-N 3.27Å
472	G	98.7	Very high	98.6	Very high	23 Å²	23	41.1 Å²	41.1	24%	0.237	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-38.6	175.5	0	0	0	0	0	113.5	E468 D470 N476	E468-G472 PolarHBondContact O-N 3.41Å; D470-G472 VanDerWaalsContact C-N 3.34Å; D470-G472 PolarHBondContact O-N 3.08Å; G472-N476 PolarHBondContact O-N 3.16Å; G472-N476 VanDerWaalsContact O-N 3.15Å; G472-N476 PolarHBondContact O-ND2 3.43Å
473	R	98.8	Very high	98.6	Very high	83 Å²	83	42.4 Å²	42.4	31%	0.313	19%	0.194	S	C	.	.	H	α-helix	trans	-66.7	-43.5	173.6	-71.9	-178.2	-153.5	92.6	-18	111.8	R469 D470 A471 N476 C477 A532	R469-R473 WeakPolarHBondContact O-CG 3.38Å; R469-R473 PolarHBondContact O-N 3.38Å; R469-R473 PolarHBondContact O-NH1 3.13Å; D470-R473 PolarHBondContact O-N 3.13Å; D470-R473 VanDerWaalsContact O-N 3.16Å; D470-R473 IonicContact OD1-CZ 2.68Å; D470-R473 IonicContact OD1-NH1 3.32Å; D470-R473 PolarHBondContact OD1-NH1 3.14Å; A471-R473 VanDerWaalsContact C-N 3.32Å; A471-R473 PolarHBondContact O-N 2.94Å; R473-N476 PolarHBondContact O-N 3.43Å; R473-C477 WeakPolarHBondContact O-CB 3.45Å; R473-C477 PolarHBondContact O-N 3.38Å; R473-A532 HydrophobicContact CB-CB 4.35Å
474	L	98.8	Very high	98.6	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.4	-41.1	178.4	-70.1	166.4	0	0	0	112.1	I416 I419 L420 I423 D470 A471 C477 R478 F529 A532	I416-L474 HydrophobicContact CG1-CD2 4.18Å; I416-L474 HydrophobicContact CG2-CB 4.06Å; I419-L474 HydrophobicContact CB-CD1 4.36Å; I419-L474 HydrophobicContact CG2-CD1 3.51Å; L420-L474 HydrophobicContact CD2-CB 3.96Å; L420-L474 HydrophobicContact CD2-CD1 4.36Å; L420-L474 HydrophobicContact CG-CB 4.37Å; I423-L474 HydrophobicContact CD1-CD1 3.66Å; D470-L474 WeakPolarHBondContact O-CG 3.39Å; D470-L474 PolarHBondContact O-N 2.96Å; A471-L474 PolarHBondContact O-N 3.1Å; A471-L474 VanDerWaalsContact O-N 3.13Å; L474-C477 PolarHBondContact O-N 3.41Å; L474-R478 WeakPolarHBondContact O-CB 3.4Å; L474-R478 PolarHBondContact O-N 3.13Å; L474-F529 HydrophobicContact CD2-CD2 3.77Å; L474-F529 HydrophobicContact CD2-CE2 3.72Å; L474-A532 HydrophobicContact CD2-CB 3.75Å; L474-A532 HydrophobicContact CG-CB 4.22Å
475	V	98.7	Very high	98.6	Very high	40 Å²	40	41.8 Å²	41.8	24%	0.242	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-47.8	172.5	171.1	0	0	0	0	111.2	L420 A471 C477 R478 E479	L420-V475 HydrophobicContact CD1-CG2 3.96Å; L420-V475 HydrophobicContact CD2-CG2 4.1Å; A471-V475 WeakPolarHBondContact O-CG2 3.41Å; A471-V475 PolarHBondContact O-N 3.27Å; V475-C477 VanDerWaalsContact C-N 3.32Å; V475-C477 PolarHBondContact O-N 3.38Å; V475-R478 VanDerWaalsContact O-CB 3.32Å; V475-R478 WeakPolarHBondContact O-CB 3.49Å; V475-R478 PolarHBondContact O-N 2.66Å; V475-E479 PolarHBondContact O-N 3.04Å; V475-E479 VanDerWaalsContact O-N 3.07Å
476	N	98.7	Very high	98.6	Very high	75 Å²	75	39 Å²	39	40%	0.401	18%	0.178	S	C	.	.	H	α-helix	trans	-63.7	-35.9	178.1	-74.3	-61	0	0	0	112.7	G472 R473 R480	G472-N476 PolarHBondContact O-N 3.16Å; G472-N476 VanDerWaalsContact O-N 3.15Å; G472-N476 PolarHBondContact O-ND2 3.43Å; R473-N476 PolarHBondContact O-N 3.43Å; N476-R480 PolarHBondContact O-N 2.67Å; N476-R480 PolarHBondContact O-NH1 2.91Å; N476-R480 PolarHBondContact O-NH2 3.02Å
477	C	98.6	Very high	98.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.007	18%	0.178	C	C	.	.	H	α-helix	trans	-66.2	-42.1	173.5	-177.6	0	0	0	0	111.3	I416 R473 L474 V475 E479 R480 L481 E528	I416-C477 HydrophobicContact CD1-CB 4.27Å; R473-C477 WeakPolarHBondContact O-CB 3.45Å; R473-C477 PolarHBondContact O-N 3.38Å; L474-C477 PolarHBondContact O-N 3.41Å; V475-C477 VanDerWaalsContact C-N 3.32Å; V475-C477 PolarHBondContact O-N 3.38Å; C477-E479 VanDerWaalsContact C-N 3.32Å; C477-E479 PolarHBondContact O-N 3.41Å; C477-R480 PolarHBondContact O-N 2.99Å; C477-R480 VanDerWaalsContact O-N 3.13Å; C477-L481 PolarHBondContact O-N 3.29Å; C477-E528 VanDerWaalsContact CA-OE1 3.31Å; C477-E528 WeakPolarHBondContact CA-OE1 3.49Å; C477-E528 HydrophobicContact CB-CG 4.34Å; C477-E528 VanDerWaalsContact CB-OE1 3.31Å; C477-E528 WeakPolarHBondContact CB-OE1 3.37Å
478	R	98.3	Very high	98.4	Very high	81 Å²	81	38.6 Å²	38.6	31%	0.306	18%	0.178	S	C	.	.	H	α-helix	trans	-58.5	-39.7	176	-163.3	-173.9	-175.6	-86.8	7.7	112.5	R413 I416 D417 L474 V475 N482	R413-R478 HydrophobicContact CG-CG 4.25Å; I416-R478 HydrophobicContact CD1-CB 4.17Å; I416-R478 HydrophobicContact CG2-CB 4.14Å; I416-R478 HydrophobicContact CG2-CG 4.31Å; D417-R478 WeakPolarHBondContact OD1-CD 3.19Å; D417-R478 IonicContact OD1-CZ 3.93Å; D417-R478 IonicContact OD1-NE 3.72Å; D417-R478 PolarHBondContact OD1-NE 3.13Å; D417-R478 IonicContact OD1-NH2 2.73Å; D417-R478 PolarHBondContact OD1-NH2 3.2Å; D417-R478 IonicContact OD2-CZ 3.82Å; D417-R478 IonicContact OD2-NE 3.14Å; D417-R478 PolarHBondContact OD2-NE 3.18Å; D417-R478 IonicContact OD2-NH2 3.01Å; D417-R478 PolarHBondContact OD2-NH2 3.49Å; L474-R478 WeakPolarHBondContact O-CB 3.4Å; L474-R478 PolarHBondContact O-N 3.13Å; V475-R478 VanDerWaalsContact O-CB 3.32Å; V475-R478 WeakPolarHBondContact O-CB 3.49Å; V475-R478 PolarHBondContact O-N 2.66Å; R478-N482 WeakPolarHBondContact O-CB 3.48Å; R478-N482 PolarHBondContact O-N 3.45Å
479	E	98.2	Very high	98.4	Very high	120 Å²	120	37.3 Å²	37.3	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-61.6	-45	174.2	-69.6	-172.1	158	0	0	112	V475 C477	V475-E479 PolarHBondContact O-N 3.04Å; V475-E479 VanDerWaalsContact O-N 3.07Å; C477-E479 VanDerWaalsContact C-N 3.32Å; C477-E479 PolarHBondContact O-N 3.41Å
480	R	98.3	Very high	98.3	Very high	128 Å²	128	34.1 Å²	34.1	48%	0.483	17%	0.171	S	C	.	.	H	α-helix	trans	-72.1	-37.3	-178	-82	-178.8	-72.5	-77.3	8.8	113.6	N476 C477 N482 F483 E528	N476-R480 PolarHBondContact O-N 2.67Å; N476-R480 PolarHBondContact O-NH1 2.91Å; N476-R480 PolarHBondContact O-NH2 3.02Å; C477-R480 PolarHBondContact O-N 2.99Å; C477-R480 VanDerWaalsContact O-N 3.13Å; R480-N482 VanDerWaalsContact C-N 3.31Å; R480-N482 PolarHBondContact O-N 3.3Å; R480-F483 WeakPolarHBondContact O-CD2 3.36Å; R480-E528 IonicContact CZ-OE1 2.67Å; R480-E528 IonicContact CZ-OE2 3.65Å; R480-E528 IonicContact NE-OE1 3.72Å; R480-E528 PolarHBondContact NE-OE1 2.93Å; R480-E528 IonicContact NE-OE2 2.73Å; R480-E528 PolarHBondContact NE-OE2 2.78Å; R480-E528 IonicContact NH2-OE1 3.96Å; R480-E528 PolarHBondContact NH2-OE1 3.23Å; R480-E528 IonicContact NH2-OE2 3.63Å
481	L	97.7	Very high	98.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-74.2	-21.5	-178.3	75.2	81.1	0	0	0	113.4	R409 C412 R413 I416 C477 F483 F525	R409-L481 WeakPolarHBondContact CD-O 3.42Å; R409-L481 PolarHBondContact NH1-O 2.98Å; R409-L481 WeakPolarHBondContact O-CD1 3.48Å; C412-L481 HydrophobicContact CB-CD2 3.9Å; R413-L481 HydrophobicContact CB-CD1 4Å; I416-L481 HydrophobicContact CD1-CD2 3.59Å; C477-L481 PolarHBondContact O-N 3.29Å; L481-F483 PolarHBondContact O-N 3.37Å; L481-F525 HydrophobicContact CB-CB 3.69Å; L481-F525 HydrophobicContact CB-CD2 4.31Å; L481-F525 HydrophobicContact CB-CG 4.32Å
482	N	98.5	Very high	98.2	Very high	14 Å²	14	41 Å²	41	8%	0.075	22%	0.217	C	C	.	.			trans	-78.7	45.9	-170.2	-161.9	59.3	0	0	0	114.3	R413 R478 R480 K508 F509 T510	R413-N482 WeakPolarHBondContact CD-OD1 3.48Å; R413-N482 PolarHBondContact NH1-OD1 3.22Å; R478-N482 WeakPolarHBondContact O-CB 3.48Å; R478-N482 PolarHBondContact O-N 3.45Å; R480-N482 VanDerWaalsContact C-N 3.31Å; R480-N482 PolarHBondContact O-N 3.3Å; N482-K508 PolarHBondContact ND2-O 2.69Å; N482-K508 VanDerWaalsContact ND2-O 3.09Å; N482-K508 PolarHBondContact OD1-O 3.48Å; N482-F509 VanDerWaalsContact C-CD1 3.48Å; N482-F509 HydrophobicContact CB-CD1 4.48Å; N482-F509 WeakPolarHBondContact ND2-CA 3.46Å; N482-F509 WeakPolarHBondContact OD1-CD1 3.33Å; N482-T510 PolarHBondContact ND2-N 3.37Å; N482-T510 VanDerWaalsContact ND2-N 3.18Å; N482-T510 PolarHBondContact ND2-OG1 3.12Å; N482-T510 WeakPolarHBondContact O-CB 3.42Å; N482-T510 PolarHBondContact O-N 3.06Å; N482-T510 PolarHBondContact O-OG1 3.42Å
483	F	98.6	Very high	98.1	Very high	70 Å²	70	41 Å²	41	31%	0.307	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.5	169.6	-69.4	-95.7	0	0	0	110.6	R409 R480 L481 P485 T510 A511 M513	R409-F483 VanDerWaalsContact CD-O 3.25Å; R409-F483 WeakPolarHBondContact CD-O 3.49Å; R480-F483 WeakPolarHBondContact O-CD2 3.36Å; L481-F483 PolarHBondContact O-N 3.37Å; F483-P485 WeakPolarHBondContact O-CD 3.45Å; F483-T510 HydrophobicContact CE1-CG2 4.22Å; F483-T510 HydrophobicContact CZ-CG2 4.08Å; F483-A511 CarbonylContact C-O 3.57Å; F483-A511 VanDerWaalsContact CA-O 3.3Å; F483-A511 WeakPolarHBondContact CA-O 3.15Å; F483-A511 HydrophobicContact CD1-CB 3.96Å; F483-A511 HydrophobicContact CE1-CB 3.97Å; F483-M513 HydrophobicContact CB-CG 3.72Å
484	C	98.6	Very high	98	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.2	-169.9	-165.5	0	0	0	0	112.4	R500 A504 F509 A511 P512 M513	C484-R500 PolarHBondContact O-NH2 2.64Å; C484-A504 HydrophobicContact CB-CB 3.59Å; C484-F509 HydrophobicContact CB-CB 3.83Å; C484-F509 HydrophobicContact CB-CD2 3.4Å; C484-F509 VanDerWaalsContact CB-CD2 3.4Å; C484-F509 HydrophobicContact CB-CE2 4.03Å; C484-F509 HydrophobicContact CB-CG 3.69Å; C484-F509 WeakPolarHBondContact SG-CD2 3.47Å; C484-A511 PolarHBondContact N-O 2.83Å; C484-P512 CarbonylContact O-C 3.59Å; C484-P512 WeakPolarHBondContact O-CA 3.34Å; C484-M513 PolarHBondContact O-N 3.19Å
485	P	98.3	Very high	97.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.259	C	S	.	.			trans	-81	-29.3	176.2	27.9	-26.5	0	0	0	112.5	V405 T406 F483 A488 R500 M513 A519	V405-P485 VanDerWaalsContact C-CG 3.46Å; V405-P485 HydrophobicContact CB-CB 4.42Å; V405-P485 HydrophobicContact CB-CG 4.01Å; V405-P485 HydrophobicContact CG1-CB 4.38Å; V405-P485 HydrophobicContact CG1-CG 4.01Å; T406-P485 WeakPolarHBondContact OG1-CG 3.36Å; F483-P485 WeakPolarHBondContact O-CD 3.45Å; P485-A488 VanDerWaalsContact O-CB 3.22Å; P485-A488 WeakPolarHBondContact O-CB 3.35Å; P485-A488 PolarHBondContact O-N 2.87Å; P485-A488 VanDerWaalsContact O-N 3.1Å; P485-R500 PolarHBondContact O-NH2 3.26Å; P485-M513 HydrophobicContact CB-SD 3.81Å; P485-M513 HydrophobicContact CG-SD 4.45Å; P485-A519 HydrophobicContact CB-CB 3.8Å; P485-A519 WeakPolarHBondContact CB-O 3.46Å
486	L	98.1	Very high	97.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.8	134.9	-177.8	-167	59.4	0	0	0	113.9	V331 H332 R398 T406 R500 T503 L507	V331-L486 HydrophobicContact CG2-CD2 4.33Å; H332-L486 HydrophobicContact CB-CD2 4.49Å; R398-L486 HydrophobicContact CG-CD1 4.12Å; T406-L486 HydrophobicContact CG2-CB 4.4Å; T406-L486 WeakPolarHBondContact OG1-CB 3.35Å; T406-L486 PolarHBondContact OG1-N 2.77Å; L486-R500 PolarHBondContact O-NE 2.91Å; L486-T503 HydrophobicContact CD2-CG2 4.26Å; L486-L507 HydrophobicContact CD2-CD1 4.42Å
487	G	97.4	Very high	97.7	Very high	4 Å²	4	46.2 Å²	46.2	4%	0.041	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	4.3	-171.2	0	0	0	0	0	114.5	D402 C489 I498	D402-G487 WeakPolarHBondContact OD2-CA 3.43Å; D402-G487 PolarHBondContact OD2-N 2.94Å; G487-C489 VanDerWaalsContact C-N 3.27Å; G487-I498 VanDerWaalsContact CA-CD1 3.46Å
488	A	97.9	Very high	97.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	28%	0.283	C	S	.	.			trans	-78	-15	165.5	0	0	0	0	0	112.7	D402 P485 G493 A519 V520	D402-A488 HydrophobicContact CB-CB 4.01Å; D402-A488 PolarHBondContact OD2-N 3.45Å; P485-A488 VanDerWaalsContact O-CB 3.22Å; P485-A488 WeakPolarHBondContact O-CB 3.35Å; P485-A488 PolarHBondContact O-N 2.87Å; P485-A488 VanDerWaalsContact O-N 3.1Å; A488-G493 VanDerWaalsContact O-CA 3.3Å; A488-G493 WeakPolarHBondContact O-CA 3.37Å; A488-G493 PolarHBondContact O-N 3.08Å; A488-A519 HydrophobicContact CB-CB 3.64Å; A488-V520 HydrophobicContact CB-CG1 4.18Å
489	C	97.4	Very high	97.6	Very high	13 Å²	13	47.1 Å²	47.1	9%	0.088	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	-134.7	-177.2	-50.9	0	0	0	0	111.3	A397 D402 G487 G493 V520	A397-C489 VanDerWaalsContact C-SG 3.59Å; A397-C489 PolarHBondContact O-SG 3.29Å; D402-C489 VanDerWaalsContact CG-CA 3.47Å; D402-C489 VanDerWaalsContact OD1-CA 3.32Å; D402-C489 WeakPolarHBondContact OD1-CA 3.3Å; D402-C489 PolarHBondContact OD2-N 3.47Å; G487-C489 VanDerWaalsContact C-N 3.27Å; C489-G493 WeakPolarHBondContact CB-O 3.26Å; C489-V520 WeakPolarHBondContact O-CG1 3.35Å
490	A	97.3	Very high	97.6	Very high	46 Å²	46	43.8 Å²	43.8	38%	0.38	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-34.5	-174.6	0	0	0	0	0	113.9	N401	N401-A490 PolarHBondContact ND2-O 2.73Å
491	L	97.4	Very high	97.6	Very high	80 Å²	80	45 Å²	45	42%	0.419	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-179.4	-21.9	177.4	63.1	105	0	0	0	113.1	S516 I517 V520 A607	L491-S516 CarbonylContact O-C 3.53Å; L491-S516 VanDerWaalsContact O-CB 3.23Å; L491-S516 WeakPolarHBondContact O-CB 3.26Å; L491-S516 PolarHBondContact O-OG 3.09Å; L491-S516 VanDerWaalsContact O-OG 3.07Å; L491-I517 HydrophobicContact CB-CG1 4.47Å; L491-I517 HydrophobicContact CD1-CG1 4.34Å; L491-I517 VanDerWaalsContact O-CG1 3.32Å; L491-I517 WeakPolarHBondContact O-CG1 3.5Å; L491-I517 PolarHBondContact O-N 3.11Å; L491-I517 VanDerWaalsContact O-N 3.16Å; L491-V520 HydrophobicContact CB-CG2 4.15Å; L491-A607 HydrophobicContact CB-CB 3.91Å
492	A	97.7	Very high	97.6	Very high	80 Å²	80	46.2 Å²	46.2	66%	0.661	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	3.8	-167.3	0	0	0	0	0	114.3
493	G	96.6	Very high	97.6	Very high	22 Å²	22	45.7 Å²	45.7	23%	0.227	28%	0.28	C	S	.	.			trans	71.5	-152.8	-163.5	0	0	0	0	0	111.5	A488 C489 S516	A488-G493 VanDerWaalsContact O-CA 3.3Å; A488-G493 WeakPolarHBondContact O-CA 3.37Å; A488-G493 PolarHBondContact O-N 3.08Å; C489-G493 WeakPolarHBondContact CB-O 3.26Å; G493-S516 PolarHBondContact N-OG 3.2Å
494	T	97.1	Very high	97.6	Very high	54 Å²	54	42.4 Å²	42.4	33%	0.331	27%	0.266	S	S	.	.			trans	-136.3	154.3	-179.1	-179.8	0	0	0	0	111.4	A397 L496 I498	A397-T494 HydrophobicContact CB-CG2 4.19Å; T494-L496 VanDerWaalsContact C-N 3.31Å; T494-L496 HydrophobicContact CG2-CB 4.47Å; T494-L496 WeakPolarHBondContact CG2-O 3.43Å; T494-L496 WeakPolarHBondContact OG1-CB 3.44Å; T494-L496 PolarHBondContact OG1-N 2.83Å; T494-I498 HydrophobicContact CG2-CD1 3.51Å; T494-I498 HydrophobicContact CG2-CG1 3.62Å; T494-I498 HydrophobicContact CG2-CG2 4.36Å
495	G	96.3	Very high	97.6	Very high	86 Å²	86	50 Å²	50	89%	0.887	30%	0.299	S	S	*	.	S	Bend	trans	-86.3	2.2	167.7	0	0	0	0	0	114
496	L	97.4	Very high	97.6	Very high	74 Å²	74	53.1 Å²	53.1	39%	0.387	32%	0.316	S	S	.	.	S	Bend	trans	-91.8	146.2	177.4	-61.4	175.5	0	0	0	110.9	L341 T396 A397 T494 I498	L341-L496 HydrophobicContact CD1-CB 4.14Å; L341-L496 HydrophobicContact CD2-CB 4.4Å; L341-L496 HydrophobicContact CD2-CD1 4.39Å; L341-L496 HydrophobicContact CD2-CD2 4.17Å; T396-L496 HydrophobicContact CG2-CD1 3.66Å; A397-L496 HydrophobicContact CB-CB 4.38Å; A397-L496 HydrophobicContact CB-CD1 4.09Å; T494-L496 VanDerWaalsContact C-N 3.31Å; T494-L496 HydrophobicContact CG2-CB 4.47Å; T494-L496 WeakPolarHBondContact CG2-O 3.43Å; T494-L496 WeakPolarHBondContact OG1-CB 3.44Å; T494-L496 PolarHBondContact OG1-N 2.83Å; L496-I498 VanDerWaalsContact C-N 3.25Å; L496-I498 PolarHBondContact O-N 2.68Å
497	P	95.6	Very high	97.6	Very high	94 Å²	94	53.7 Å²	53.7	61%	0.61	32%	0.319	S	S	*	.			trans	-79.2	63.8	-171.6	34.6	-38.4	0	0	0	112.9	T339	T339-P497 WeakPolarHBondContact CB-O 3.48Å; T339-P497 WeakPolarHBondContact CG2-O 3.39Å
498	I	97.9	Very high	97.7	Very high	33 Å²	33	60.8 Å²	60.8	17%	0.169	35%	0.348	C	S	.	.			trans	-81.4	148.8	178.4	63.6	168.5	0	0	0	112.9	M335 L341 A397 G487 T494 L496 R500	M335-I498 HydrophobicContact CE-CB 3.89Å; M335-I498 HydrophobicContact CE-CG2 3.75Å; M335-I498 HydrophobicContact SD-CB 3.57Å; M335-I498 VanDerWaalsContact SD-CB 3.57Å; M335-I498 HydrophobicContact SD-CG2 3.7Å; L341-I498 HydrophobicContact CD1-CG2 3.98Å; A397-I498 HydrophobicContact CB-CG2 3.46Å; A397-I498 VanDerWaalsContact CB-CG2 3.46Å; G487-I498 VanDerWaalsContact CA-CD1 3.46Å; T494-I498 HydrophobicContact CG2-CD1 3.51Å; T494-I498 HydrophobicContact CG2-CG1 3.62Å; T494-I498 HydrophobicContact CG2-CG2 4.36Å; L496-I498 VanDerWaalsContact C-N 3.25Å; L496-I498 PolarHBondContact O-N 2.68Å; I498-R500 HydrophobicContact CD1-CG 3.97Å; I498-R500 HydrophobicContact CG1-CG 4.33Å
499	D	98.1	Very high	97.7	Very high	68 Å²	68	61.3 Å²	61.3	36%	0.364	35%	0.35	S	S	.	.			trans	-100.2	103.5	169.4	-173.2	-7.4	0	0	0	111.3	M335 F501 K502 T503	M335-D499 HydrophobicContact CG-CB 4.41Å; M335-D499 WeakPolarHBondContact CG-O 3.48Å; D499-F501 WeakPolarHBondContact OD1-CA 3.27Å; D499-F501 WeakPolarHBondContact OD1-CB 3.32Å; D499-F501 PolarHBondContact OD1-N 3.48Å; D499-K502 HydrophobicContact CB-CB 3.93Å; D499-K502 VanDerWaalsContact CG-CB 3.48Å; D499-K502 PolarHBondContact OD1-N 2.91Å; D499-K502 WeakPolarHBondContact OD2-CB 3.34Å; D499-T503 PolarHBondContact O-N 3.41Å
500	R	98.2	Very high	97.7	Very high	50 Å²	50	65.2 Å²	65.2	19%	0.189	37%	0.374	C	S	.	.	H	α-helix	trans	-75.9	-27.8	174	-62.6	-178.4	67.4	-138	2.2	113	C484 P485 L486 I498 T503 A504 P512 M513	C484-R500 PolarHBondContact O-NH2 2.64Å; P485-R500 PolarHBondContact O-NH2 3.26Å; L486-R500 PolarHBondContact O-NE 2.91Å; I498-R500 HydrophobicContact CD1-CG 3.97Å; I498-R500 HydrophobicContact CG1-CG 4.33Å; R500-T503 PolarHBondContact O-OG1 3.41Å; R500-A504 VanDerWaalsContact O-CB 3.27Å; R500-A504 WeakPolarHBondContact O-CB 3.42Å; R500-A504 PolarHBondContact O-N 3.1Å; R500-P512 HydrophobicContact CB-CB 4.03Å; R500-P512 HydrophobicContact CB-CG 3.87Å; R500-P512 WeakPolarHBondContact O-CG 3.27Å; R500-M513 PolarHBondContact NH1-O 3.49Å; R500-M513 PolarHBondContact NH2-O 3.09Å; R500-M513 VanDerWaalsContact NH2-O 3.17Å
501	F	98.4	Very high	97.8	Very high	153 Å²	153	64.4 Å²	64.4	67%	0.671	37%	0.368	S	S	*	.	H	α-helix	trans	-69.8	-38.2	178.1	-72.4	-85.3	0	0	0	110.8	D499 K505 P512	D499-F501 WeakPolarHBondContact OD1-CA 3.27Å; D499-F501 WeakPolarHBondContact OD1-CB 3.32Å; D499-F501 PolarHBondContact OD1-N 3.48Å; F501-K505 VanDerWaalsContact O-CB 3.3Å; F501-K505 WeakPolarHBondContact O-CB 3.29Å; F501-K505 PolarHBondContact O-N 3.19Å; F501-P512 VanDerWaalsContact CD1-CD 3.46Å; F501-P512 HydrophobicContact CD1-CG 3.82Å; F501-P512 HydrophobicContact CD2-CG 4.29Å; F501-P512 HydrophobicContact CE1-CG 4.05Å; F501-P512 HydrophobicContact CE2-CG 4.5Å; F501-P512 HydrophobicContact CG-CG 3.95Å; F501-P512 HydrophobicContact CZ-CG 4.38Å
502	K	97.8	Very high	97.8	Very high	26 Å²	26	61.1 Å²	61.1	11%	0.113	35%	0.351	C	S	.	.	H	α-helix	trans	-56	-58.3	168.7	174.2	-178.5	170.5	63.3	0	111.9	M335 E338 D499 A504 K505 D506	M335-K502 HydrophobicContact CB-CD 4.03Å; M335-K502 HydrophobicContact CG-CD 4.26Å; E338-K502 VanDerWaalsContact OE1-CE 3.24Å; E338-K502 WeakPolarHBondContact OE1-CE 3.42Å; E338-K502 IonicContact OE1-NZ 2.64Å; E338-K502 PolarHBondContact OE1-NZ 3.12Å; E338-K502 VanDerWaalsContact OE2-CD 3.24Å; E338-K502 WeakPolarHBondContact OE2-CD 3.5Å; E338-K502 WeakPolarHBondContact OE2-CE 3.39Å; E338-K502 IonicContact OE2-NZ 3.55Å; E338-K502 PolarHBondContact OE2-NZ 3.2Å; D499-K502 HydrophobicContact CB-CB 3.93Å; D499-K502 VanDerWaalsContact CG-CB 3.48Å; D499-K502 PolarHBondContact OD1-N 2.91Å; D499-K502 WeakPolarHBondContact OD2-CB 3.34Å; K502-A504 VanDerWaalsContact C-N 3.29Å; K502-A504 PolarHBondContact O-N 2.69Å; K502-K505 WeakPolarHBondContact O-CB 3.49Å; K502-K505 PolarHBondContact O-N 2.91Å; K502-K505 VanDerWaalsContact O-N 3.11Å; K502-D506 WeakPolarHBondContact CE-OD2 3.39Å; K502-D506 WeakPolarHBondContact CG-OD2 3.33Å; K502-D506 IonicContact NZ-OD2 3.44Å; K502-D506 PolarHBondContact NZ-OD2 3.06Å; K502-D506 WeakPolarHBondContact O-CB 3.38Å; K502-D506 VanDerWaalsContact O-CG 3.31Å; K502-D506 PolarHBondContact O-N 3.44Å
503	T	98.2	Very high	97.9	Very high	3 Å²	3	58 Å²	58	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-34.4	-175.5	54.4	0	0	0	0	112.4	V331 M335 L486 D499 R500 L507	V331-T503 HydrophobicContact CG2-CG2 4.3Å; M335-T503 HydrophobicContact CB-CG2 3.63Å; M335-T503 HydrophobicContact CG-CG2 3.87Å; L486-T503 HydrophobicContact CD2-CG2 4.26Å; D499-T503 PolarHBondContact O-N 3.41Å; R500-T503 PolarHBondContact O-OG1 3.41Å; T503-L507 WeakPolarHBondContact O-CB 3.31Å; T503-L507 WeakPolarHBondContact O-CG 3.31Å; T503-L507 PolarHBondContact O-N 3.45Å; T503-L507 VanDerWaalsContact O-N 3.09Å
504	A	98.5	Very high	97.9	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.008	35%	0.354	C	S	.	.	H	α-helix	trans	-59.4	-50.9	170.4	0	0	0	0	0	111.8	C484 R500 K502 L507 K508 F509 P512	C484-A504 HydrophobicContact CB-CB 3.59Å; R500-A504 VanDerWaalsContact O-CB 3.27Å; R500-A504 WeakPolarHBondContact O-CB 3.42Å; R500-A504 PolarHBondContact O-N 3.1Å; K502-A504 VanDerWaalsContact C-N 3.29Å; K502-A504 PolarHBondContact O-N 2.69Å; A504-L507 CarbonylContact O-C 3.12Å; A504-L507 PolarHBondContact O-N 3.44Å; A504-K508 PolarHBondContact O-N 2.71Å; A504-F509 HydrophobicContact CB-CB 4.14Å; A504-F509 WeakPolarHBondContact O-CB 3.43Å; A504-F509 PolarHBondContact O-N 3.35Å; A504-P512 HydrophobicContact CB-CG 4.1Å
505	K	98.4	Very high	98	Very high	160 Å²	160	68.1 Å²	68.1	70%	0.696	36%	0.36	S	S	*	.	H	α-helix	trans	-60.4	-47.7	178.3	178.8	-169.3	173.5	-167.6	0	112	F501 K502 L507 K508	F501-K505 VanDerWaalsContact O-CB 3.3Å; F501-K505 WeakPolarHBondContact O-CB 3.29Å; F501-K505 PolarHBondContact O-N 3.19Å; K502-K505 WeakPolarHBondContact O-CB 3.49Å; K502-K505 PolarHBondContact O-N 2.91Å; K502-K505 VanDerWaalsContact O-N 3.11Å; K505-L507 PolarHBondContact O-N 2.95Å; K505-K508 PolarHBondContact O-N 3.47Å
506	D	98.3	Very high	98.1	Very high	67 Å²	67	65.4 Å²	65.4	36%	0.358	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-27.1	-176	-66	-10.1	0	0	0	111.3	V331 K502	V331-D506 HydrophobicContact CB-CB 4.27Å; V331-D506 HydrophobicContact CG1-CB 3.78Å; K502-D506 WeakPolarHBondContact CE-OD2 3.39Å; K502-D506 WeakPolarHBondContact CG-OD2 3.33Å; K502-D506 IonicContact NZ-OD2 3.44Å; K502-D506 PolarHBondContact NZ-OD2 3.06Å; K502-D506 WeakPolarHBondContact O-CB 3.38Å; K502-D506 VanDerWaalsContact O-CG 3.31Å; K502-D506 PolarHBondContact O-N 3.44Å
507	L	98.3	Very high	98.2	Very high	13 Å²	13	65.1 Å²	65.1	7%	0.068	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	6.5	170.5	-68.5	173.3	0	0	0	115	A327 V331 T406 L410 R413 L486 T503 A504 K505 F509	A327-L507 HydrophobicContact CB-CD2 4.48Å; V331-L507 HydrophobicContact CB-CG 4.41Å; V331-L507 HydrophobicContact CG1-CD2 3.88Å; V331-L507 HydrophobicContact CG1-CG 4.03Å; V331-L507 HydrophobicContact CG2-CD1 3.68Å; V331-L507 HydrophobicContact CG2-CD2 3.89Å; V331-L507 HydrophobicContact CG2-CG 3.62Å; T406-L507 HydrophobicContact CG2-CD1 3.81Å; L410-L507 HydrophobicContact CD1-CD1 4.48Å; L410-L507 HydrophobicContact CD1-CD2 4.14Å; L410-L507 HydrophobicContact CD2-CB 4.33Å; R413-L507 PolarHBondContact NH1-O 3.09Å; R413-L507 PolarHBondContact NH2-O 2.93Å; L486-L507 HydrophobicContact CD2-CD1 4.42Å; T503-L507 WeakPolarHBondContact O-CB 3.31Å; T503-L507 WeakPolarHBondContact O-CG 3.31Å; T503-L507 PolarHBondContact O-N 3.45Å; T503-L507 VanDerWaalsContact O-N 3.09Å; A504-L507 CarbonylContact O-C 3.12Å; A504-L507 PolarHBondContact O-N 3.44Å; K505-L507 PolarHBondContact O-N 2.95Å; L507-F509 VanDerWaalsContact C-N 3.25Å; L507-F509 HydrophobicContact CB-CD2 3.61Å; L507-F509 HydrophobicContact CB-CE2 3.84Å; L507-F509 HydrophobicContact CD1-CD2 4.31Å; L507-F509 HydrophobicContact CD1-CE2 3.98Å; L507-F509 PolarHBondContact O-N 2.92Å
508	K	98.1	Very high	98.3	Very high	153 Å²	153	63.9 Å²	63.9	67%	0.665	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	25	-179	-48.6	176.5	-175	175.3	0	114.6	R413 N482 A504 K505	R413-K508 PolarHBondContact NH1-O 3.32Å; N482-K508 PolarHBondContact ND2-O 2.69Å; N482-K508 VanDerWaalsContact ND2-O 3.09Å; N482-K508 PolarHBondContact OD1-O 3.48Å; A504-K508 PolarHBondContact O-N 2.71Å; K505-K508 PolarHBondContact O-N 3.47Å
509	F	98.7	Very high	98.3	Very high	11 Å²	11	62.3 Å²	62.3	5%	0.048	31%	0.306	C	S	.	.			trans	-75.6	152	167.6	-70.9	-67.1	0	0	0	111.3	T406 R409 L410 N482 C484 A504 L507	T406-F509 HydrophobicContact CG2-CE2 3.96Å; T406-F509 HydrophobicContact CG2-CZ 4.36Å; R409-F509 HydrophobicContact CB-CE1 3.93Å; R409-F509 HydrophobicContact CB-CZ 4Å; L410-F509 HydrophobicContact CD2-CE1 4.31Å; L410-F509 HydrophobicContact CD2-CE2 3.68Å; L410-F509 HydrophobicContact CD2-CZ 3.55Å; L410-F509 HydrophobicContact CG-CE2 4.12Å; L410-F509 HydrophobicContact CG-CZ 3.81Å; N482-F509 VanDerWaalsContact C-CD1 3.48Å; N482-F509 HydrophobicContact CB-CD1 4.48Å; N482-F509 WeakPolarHBondContact ND2-CA 3.46Å; N482-F509 WeakPolarHBondContact OD1-CD1 3.33Å; C484-F509 HydrophobicContact CB-CB 3.83Å; C484-F509 HydrophobicContact CB-CD2 3.4Å; C484-F509 VanDerWaalsContact CB-CD2 3.4Å; C484-F509 HydrophobicContact CB-CE2 4.03Å; C484-F509 HydrophobicContact CB-CG 3.69Å; C484-F509 WeakPolarHBondContact SG-CD2 3.47Å; A504-F509 HydrophobicContact CB-CB 4.14Å; A504-F509 WeakPolarHBondContact O-CB 3.43Å; A504-F509 PolarHBondContact O-N 3.35Å; L507-F509 VanDerWaalsContact C-N 3.25Å; L507-F509 HydrophobicContact CB-CD2 3.61Å; L507-F509 HydrophobicContact CB-CE2 3.84Å; L507-F509 HydrophobicContact CD1-CD2 4.31Å; L507-F509 HydrophobicContact CD1-CE2 3.98Å; L507-F509 PolarHBondContact O-N 2.92Å
510	T	98.4	Very high	98.3	Very high	96 Å²	96	59.1 Å²	59.1	59%	0.589	29%	0.289	S	S	*	.	S	Bend	trans	-66.3	-43.9	-178.6	-53.6	0	0	0	0	111.9	N482 F483	N482-T510 PolarHBondContact ND2-N 3.37Å; N482-T510 VanDerWaalsContact ND2-N 3.18Å; N482-T510 PolarHBondContact ND2-OG1 3.12Å; N482-T510 WeakPolarHBondContact O-CB 3.42Å; N482-T510 PolarHBondContact O-N 3.06Å; N482-T510 PolarHBondContact O-OG1 3.42Å; F483-T510 HydrophobicContact CE1-CG2 4.22Å; F483-T510 HydrophobicContact CZ-CG2 4.08Å
511	A	98.4	Very high	98.3	Very high	29 Å²	29	57.4 Å²	57.4	24%	0.24	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	170.9	174.6	0	0	0	0	0	110.1	F483 C484	F483-A511 CarbonylContact C-O 3.57Å; F483-A511 VanDerWaalsContact CA-O 3.3Å; F483-A511 WeakPolarHBondContact CA-O 3.15Å; F483-A511 HydrophobicContact CD1-CB 3.96Å; F483-A511 HydrophobicContact CE1-CB 3.97Å; C484-A511 PolarHBondContact N-O 2.83Å
512	P	98.5	Very high	98.3	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.071	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	148	166.9	-19	33	0	0	0	112.3	C484 R500 F501 A504	C484-P512 CarbonylContact O-C 3.59Å; C484-P512 WeakPolarHBondContact O-CA 3.34Å; R500-P512 HydrophobicContact CB-CB 4.03Å; R500-P512 HydrophobicContact CB-CG 3.87Å; R500-P512 WeakPolarHBondContact O-CG 3.27Å; F501-P512 VanDerWaalsContact CD1-CD 3.46Å; F501-P512 HydrophobicContact CD1-CG 3.82Å; F501-P512 HydrophobicContact CD2-CG 4.29Å; F501-P512 HydrophobicContact CE1-CG 4.05Å; F501-P512 HydrophobicContact CE2-CG 4.5Å; F501-P512 HydrophobicContact CG-CG 3.95Å; F501-P512 HydrophobicContact CZ-CG 4.38Å; A504-P512 HydrophobicContact CB-CG 4.1Å
513	M	98.5	Very high	98.3	Very high	14 Å²	14	50.4 Å²	50.4	7%	0.069	26%	0.255	C	S	.	.			trans	-64.3	136.1	166.9	-68.8	-175.6	74	0	0	110.2	R409 F483 C484 P485 R500 N515 D518 A519 D522	R409-M513 VanDerWaalsContact CZ-SD 3.57Å; R409-M513 PolarHBondContact NH2-SD 3.24Å; F483-M513 HydrophobicContact CB-CG 3.72Å; C484-M513 PolarHBondContact O-N 3.19Å; P485-M513 HydrophobicContact CB-SD 3.81Å; P485-M513 HydrophobicContact CG-SD 4.45Å; R500-M513 PolarHBondContact NH1-O 3.49Å; R500-M513 PolarHBondContact NH2-O 3.09Å; R500-M513 VanDerWaalsContact NH2-O 3.17Å; M513-N515 PolarHBondContact O-N 3.02Å; M513-D518 WeakPolarHBondContact CE-OD2 3.38Å; M513-A519 HydrophobicContact CB-CB 3.94Å; M513-A519 HydrophobicContact CE-CB 4.36Å; M513-A519 HydrophobicContact SD-CB 4Å; M513-D522 HydrophobicContact CE-CB 4.13Å
514	K	98	Very high	98.3	Very high	205 Å²	205	55.8 Å²	55.8	89%	0.891	28%	0.284	S	S	*	.	S	Bend	trans	-77.4	-21.6	-164.6	-65.3	178.2	-178.3	173.7	0	114.6
515	N	98.6	Very high	98.3	Very high	83 Å²	83	56.1 Å²	56.1	44%	0.444	29%	0.285	S	S	.	.			trans	-130	136.7	-178.2	179	-31.1	0	0	0	108.8	M513 I517 D518 A519	M513-N515 PolarHBondContact O-N 3.02Å; N515-I517 WeakPolarHBondContact OD1-CB 3.31Å; N515-I517 PolarHBondContact OD1-N 3.27Å; N515-D518 HydrophobicContact CB-CB 3.77Å; N515-D518 PolarHBondContact OD1-N 2.91Å; N515-A519 VanDerWaalsContact O-CB 3.22Å; N515-A519 WeakPolarHBondContact O-CB 3.42Å; N515-A519 PolarHBondContact O-N 2.95Å
516	S	98.3	Very high	98.3	Very high	29 Å²	29	48.5 Å²	48.5	20%	0.203	25%	0.252	C	S	.	.	H	α-helix	trans	-80.5	-25.8	-175.6	41.2	0	0	0	0	114.3	L491 G493	L491-S516 CarbonylContact O-C 3.53Å; L491-S516 VanDerWaalsContact O-CB 3.23Å; L491-S516 WeakPolarHBondContact O-CB 3.26Å; L491-S516 PolarHBondContact O-OG 3.09Å; L491-S516 VanDerWaalsContact O-OG 3.07Å; G493-S516 PolarHBondContact N-OG 3.2Å
517	I	98.6	Very high	98.3	Very high	69 Å²	69	46.7 Å²	46.7	35%	0.354	24%	0.242	S	C	.	.	H	α-helix	trans	-72.1	-44.9	173.7	-69.3	175.1	0	0	0	109.6	L491 N515 V520 S521 Q606 A607	L491-I517 HydrophobicContact CB-CG1 4.47Å; L491-I517 HydrophobicContact CD1-CG1 4.34Å; L491-I517 VanDerWaalsContact O-CG1 3.32Å; L491-I517 WeakPolarHBondContact O-CG1 3.5Å; L491-I517 PolarHBondContact O-N 3.11Å; L491-I517 VanDerWaalsContact O-N 3.16Å; N515-I517 WeakPolarHBondContact OD1-CB 3.31Å; N515-I517 PolarHBondContact OD1-N 3.27Å; I517-V520 WeakPolarHBondContact O-CG2 3.16Å; I517-S521 WeakPolarHBondContact O-CB 3.41Å; I517-S521 PolarHBondContact O-N 3.18Å; I517-S521 PolarHBondContact O-OG 3.37Å; I517-Q606 HydrophobicContact CG2-CB 4.24Å; I517-Q606 HydrophobicContact CG2-CG 4.42Å; I517-A607 HydrophobicContact CG2-CB 3.97Å
518	D	98.4	Very high	98.4	Very high	68 Å²	68	48.8 Å²	48.8	36%	0.364	25%	0.251	S	S	.	.	H	α-helix	trans	-56.8	-54	171.3	174.9	60.9	0	0	0	111.2	M513 N515 V520 S521 D522	M513-D518 WeakPolarHBondContact CE-OD2 3.38Å; N515-D518 HydrophobicContact CB-CB 3.77Å; N515-D518 PolarHBondContact OD1-N 2.91Å; D518-V520 PolarHBondContact O-N 3.35Å; D518-S521 PolarHBondContact O-N 3.2Å; D518-S521 PolarHBondContact O-OG 3.04Å; D518-D522 WeakPolarHBondContact O-CB 3.34Å; D518-D522 PolarHBondContact O-N 2.83Å
519	A	98.3	Very high	98.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-25.2	-177.5	0	0	0	0	0	116.3	P485 A488 M513 N515	P485-A519 HydrophobicContact CB-CB 3.8Å; P485-A519 WeakPolarHBondContact CB-O 3.46Å; A488-A519 HydrophobicContact CB-CB 3.64Å; M513-A519 HydrophobicContact CB-CB 3.94Å; M513-A519 HydrophobicContact CE-CB 4.36Å; M513-A519 HydrophobicContact SD-CB 4Å; N515-A519 VanDerWaalsContact O-CB 3.22Å; N515-A519 WeakPolarHBondContact O-CB 3.42Å; N515-A519 PolarHBondContact O-N 2.95Å
520	V	98.3	Very high	98.4	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-100.1	-15.3	178	-59	0	0	0	0	114	N401 D402 A488 C489 L491 I517 D518 A607	N401-V520 HydrophobicContact CB-CB 4.09Å; N401-V520 HydrophobicContact CB-CG1 3.86Å; D402-V520 HydrophobicContact CB-CG1 4.29Å; A488-V520 HydrophobicContact CB-CG1 4.18Å; C489-V520 WeakPolarHBondContact O-CG1 3.35Å; L491-V520 HydrophobicContact CB-CG2 4.15Å; I517-V520 WeakPolarHBondContact O-CG2 3.16Å; D518-V520 PolarHBondContact O-N 3.35Å; V520-A607 HydrophobicContact CG2-CB 3.99Å
521	S	98	Very high	98.4	Very high	14 Å²	14	38 Å²	38	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-105.1	-26.7	-176.7	61.2	0	0	0	0	113.5	I517 D518 R523 Q606	I517-S521 WeakPolarHBondContact O-CB 3.41Å; I517-S521 PolarHBondContact O-N 3.18Å; I517-S521 PolarHBondContact O-OG 3.37Å; D518-S521 PolarHBondContact O-N 3.2Å; D518-S521 PolarHBondContact O-OG 3.04Å; S521-R523 PolarHBondContact O-N 3.01Å; S521-Q606 VanDerWaalsContact CB-OE1 3.24Å; S521-Q606 PolarHBondContact OG-NE2 3.43Å; S521-Q606 PolarHBondContact OG-OE1 3.09Å
522	D	97.9	Very high	98.5	Very high	28 Å²	28	36.9 Å²	36.9	15%	0.15	19%	0.193	C	C	.	.			trans	-56.9	134.3	-175.2	-179.1	23.9	0	0	0	112.5	R409 M513 D518 D524	R409-D522 IonicContact CZ-OD2 3.43Å; R409-D522 IonicContact NH1-OD2 2.78Å; R409-D522 IonicContact NH2-OD2 3.6Å; R409-D522 PolarHBondContact NH2-OD2 3.34Å; M513-D522 HydrophobicContact CE-CB 4.13Å; D518-D522 WeakPolarHBondContact O-CB 3.34Å; D518-D522 PolarHBondContact O-N 2.83Å; D522-D524 WeakPolarHBondContact OD1-CB 3.38Å; D522-D524 PolarHBondContact OD1-N 3.37Å
523	R	98.2	Very high	98.5	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.019	19%	0.19	C	C	.	.			trans	-139.1	9.3	168.8	-69.7	-57.2	-175.5	-72.7	0.4	112.9	S521 F525 V526 L527 L612 D615	S521-R523 PolarHBondContact O-N 3.01Å; R523-F525 PolarHBondContact O-N 2.74Å; R523-V526 WeakPolarHBondContact O-CA 3.4Å; R523-V526 WeakPolarHBondContact O-CB 3.4Å; R523-V526 PolarHBondContact O-N 2.91Å; R523-L527 PolarHBondContact O-N 3.39Å; R523-L612 HydrophobicContact CG-CD2 4.04Å; R523-L612 PolarHBondContact NH2-O 3.42Å; R523-D615 IonicContact CZ-OD2 3.46Å; R523-D615 IonicContact NE-OD2 3.47Å; R523-D615 PolarHBondContact NE-OD2 3.43Å; R523-D615 IonicContact NH2-OD2 2.71Å; R523-D615 PolarHBondContact NH2-OD2 3.02Å
524	D	98.3	Very high	98.5	Very high	116 Å²	116	36.1 Å²	36.1	62%	0.62	19%	0.19	S	C	*	.	H	α-helix	trans	-60.2	-33	177.9	-75	5.2	0	0	0	110.8	D522 V526 L527 E528	D522-D524 WeakPolarHBondContact OD1-CB 3.38Å; D522-D524 PolarHBondContact OD1-N 3.37Å; D524-V526 VanDerWaalsContact C-N 3.31Å; D524-V526 PolarHBondContact O-N 3.4Å; D524-L527 PolarHBondContact O-N 3.45Å; D524-E528 WeakPolarHBondContact O-CB 3.09Å; D524-E528 PolarHBondContact O-N 2.88Å
525	F	98.4	Very high	98.5	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.035	16%	0.162	C	C	.	.	H	α-helix	trans	-64	-31.6	172.5	75.8	-83.8	0	0	0	114	V405 L408 R409 L481 R523 F529	V405-F525 HydrophobicContact CG1-CE1 4.02Å; V405-F525 HydrophobicContact CG1-CZ 4.19Å; L408-F525 HydrophobicContact CB-CZ 4.44Å; L408-F525 HydrophobicContact CD2-CE2 4.43Å; L408-F525 HydrophobicContact CD2-CZ 4.17Å; L408-F525 HydrophobicContact CG-CE2 4.32Å; L408-F525 HydrophobicContact CG-CZ 4.4Å; R409-F525 HydrophobicContact CG-CD2 4.03Å; R409-F525 HydrophobicContact CG-CE1 4.18Å; R409-F525 HydrophobicContact CG-CE2 3.66Å; R409-F525 HydrophobicContact CG-CG 4.44Å; R409-F525 HydrophobicContact CG-CZ 3.74Å; L481-F525 HydrophobicContact CB-CB 3.69Å; L481-F525 HydrophobicContact CB-CD2 4.31Å; L481-F525 HydrophobicContact CB-CG 4.32Å; R523-F525 PolarHBondContact O-N 2.74Å; F525-F529 WeakPolarHBondContact O-CB 3.4Å; F525-F529 PolarHBondContact O-N 3.39Å
526	V	98.5	Very high	98.5	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-76	-44.2	174.6	178.8	0	0	0	0	109.9	L408 R523 D524 E528 F529 L530 V597 L619	L408-V526 HydrophobicContact CD2-CG2 4.07Å; R523-V526 WeakPolarHBondContact O-CA 3.4Å; R523-V526 WeakPolarHBondContact O-CB 3.4Å; R523-V526 PolarHBondContact O-N 2.91Å; D524-V526 VanDerWaalsContact C-N 3.31Å; D524-V526 PolarHBondContact O-N 3.4Å; V526-E528 PolarHBondContact O-N 2.87Å; V526-F529 PolarHBondContact O-N 2.88Å; V526-L530 HydrophobicContact CG1-CD1 3.87Å; V526-L530 HydrophobicContact CG1-CG 4.37Å; V526-L530 WeakPolarHBondContact O-CB 3.41Å; V526-L530 VanDerWaalsContact O-CG 3.28Å; V526-L530 WeakPolarHBondContact O-CG 3.33Å; V526-L530 PolarHBondContact O-N 2.87Å; V526-V597 HydrophobicContact CG1-CG1 4.17Å; V526-L619 HydrophobicContact CG1-CB 4.25Å; V526-L619 HydrophobicContact CG1-CD1 4.32Å; V526-L619 HydrophobicContact CG1-CD2 4.05Å; V526-L619 HydrophobicContact CG1-CG 4.44Å; V526-L619 HydrophobicContact CG2-CD2 4.11Å
527	L	98.7	Very high	98.6	Very high	29 Å²	29	24.1 Å²	24.1	15%	0.152	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-43.2	176.5	-65	177.6	0	0	0	111.9	R523 D524 A531 V597 L598	R523-L527 PolarHBondContact O-N 3.39Å; D524-L527 PolarHBondContact O-N 3.45Å; L527-A531 WeakPolarHBondContact O-CB 3.28Å; L527-A531 PolarHBondContact O-N 3.36Å; L527-V597 HydrophobicContact CD2-CB 3.94Å; L527-V597 HydrophobicContact CD2-CG1 3.66Å; L527-V597 HydrophobicContact CG-CG1 4.48Å; L527-L598 HydrophobicContact CD1-CD2 4.29Å; L527-L598 HydrophobicContact CD2-CB 4.49Å; L527-L598 HydrophobicContact CD2-CD2 3.86Å; L527-L598 HydrophobicContact CD2-CG 3.98Å
528	E	98.8	Very high	98.6	Very high	56 Å²	56	23.7 Å²	23.7	26%	0.262	13%	0.133	S	C	.	.	H	α-helix	trans	-67.6	-42.2	178.6	-162.3	-167.4	147.9	0	0	111.8	C477 R480 D524 V526 A531 A532	C477-E528 VanDerWaalsContact CA-OE1 3.31Å; C477-E528 WeakPolarHBondContact CA-OE1 3.49Å; C477-E528 HydrophobicContact CB-CG 4.34Å; C477-E528 VanDerWaalsContact CB-OE1 3.31Å; C477-E528 WeakPolarHBondContact CB-OE1 3.37Å; R480-E528 IonicContact CZ-OE1 2.67Å; R480-E528 IonicContact CZ-OE2 3.65Å; R480-E528 IonicContact NE-OE1 3.72Å; R480-E528 PolarHBondContact NE-OE1 2.93Å; R480-E528 IonicContact NE-OE2 2.73Å; R480-E528 PolarHBondContact NE-OE2 2.78Å; R480-E528 IonicContact NH2-OE1 3.96Å; R480-E528 PolarHBondContact NH2-OE1 3.23Å; R480-E528 IonicContact NH2-OE2 3.63Å; D524-E528 WeakPolarHBondContact O-CB 3.09Å; D524-E528 PolarHBondContact O-N 2.88Å; V526-E528 PolarHBondContact O-N 2.87Å; E528-A531 WeakPolarHBondContact O-CB 3.34Å; E528-A531 PolarHBondContact O-N 3.45Å; E528-A532 PolarHBondContact O-N 3.22Å
529	F	98.8	Very high	98.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-43.5	177.9	-173	-165.2	0	0	0	111.6	W411 C412 A415 I416 I419 L474 F525 V526 A531 A532 N533 L619 V623	W411-F529 HydrophobicContact CZ3-CE1 4.19Å; C412-F529 HydrophobicContact CB-CD1 4.11Å; C412-F529 HydrophobicContact CB-CE1 4.24Å; A415-F529 HydrophobicContact CB-CE1 3.9Å; A415-F529 HydrophobicContact CB-CZ 3.87Å; I416-F529 HydrophobicContact CD1-CD2 4.3Å; I416-F529 HydrophobicContact CD1-CE2 4.41Å; I416-F529 HydrophobicContact CD1-CG 4.45Å; I416-F529 HydrophobicContact CG1-CD1 4.42Å; I416-F529 HydrophobicContact CG1-CD2 3.92Å; I416-F529 HydrophobicContact CG1-CE1 4.09Å; I416-F529 HydrophobicContact CG1-CE2 3.55Å; I416-F529 HydrophobicContact CG1-CG 4.35Å; I416-F529 HydrophobicContact CG1-CZ 3.63Å; I419-F529 HydrophobicContact CD1-CE2 3.82Å; I419-F529 HydrophobicContact CD1-CZ 3.89Å; L474-F529 HydrophobicContact CD2-CD2 3.77Å; L474-F529 HydrophobicContact CD2-CE2 3.72Å; F525-F529 WeakPolarHBondContact O-CB 3.4Å; F525-F529 PolarHBondContact O-N 3.39Å; V526-F529 PolarHBondContact O-N 2.88Å; F529-A531 VanDerWaalsContact C-N 3.27Å; F529-A531 PolarHBondContact O-N 3.23Å; F529-A532 PolarHBondContact O-N 3.34Å; F529-N533 VanDerWaalsContact CE2-OD1 3.28Å; F529-N533 WeakPolarHBondContact CE2-OD1 3.3Å; F529-N533 WeakPolarHBondContact O-CB 3.36Å; F529-N533 PolarHBondContact O-N 3.34Å; F529-L619 HydrophobicContact CD1-CD1 3.69Å; F529-L619 HydrophobicContact CE1-CD1 4.07Å; F529-V623 HydrophobicContact CE1-CG2 3.65Å; F529-V623 HydrophobicContact CE2-CG2 4.25Å; F529-V623 HydrophobicContact CZ-CG2 3.42Å; F529-V623 VanDerWaalsContact CZ-CG2 3.42Å
530	L	98.8	Very high	98.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-34.2	172.4	-73.5	173.7	0	0	0	112.5	V526 S534 D593 L594 V597 S622	V526-L530 HydrophobicContact CG1-CD1 3.87Å; V526-L530 HydrophobicContact CG1-CG 4.37Å; V526-L530 WeakPolarHBondContact O-CB 3.41Å; V526-L530 VanDerWaalsContact O-CG 3.28Å; V526-L530 WeakPolarHBondContact O-CG 3.33Å; V526-L530 PolarHBondContact O-N 2.87Å; L530-S534 VanDerWaalsContact O-CB 3.32Å; L530-S534 WeakPolarHBondContact O-CB 3.33Å; L530-S534 PolarHBondContact O-N 2.77Å; L530-S534 PolarHBondContact O-OG 2.93Å; L530-D593 HydrophobicContact CD2-CB 4Å; L530-L594 HydrophobicContact CB-CB 4.07Å; L530-L594 HydrophobicContact CB-CD1 3.77Å; L530-V597 HydrophobicContact CD1-CB 3.8Å; L530-V597 HydrophobicContact CD1-CG1 4.47Å; L530-V597 HydrophobicContact CD1-CG2 3.54Å; L530-S622 WeakPolarHBondContact CD2-OG 3.47Å
531	A	98.9	Very high	98.6	Very high	33 Å²	33	23 Å²	23	27%	0.273	13%	0.13	S	C	.	.	H	α-helix	trans	-70.7	-41.3	174.3	0	0	0	0	0	112.4	L527 E528 F529 S534 I535 L594	L527-A531 WeakPolarHBondContact O-CB 3.28Å; L527-A531 PolarHBondContact O-N 3.36Å; E528-A531 WeakPolarHBondContact O-CB 3.34Å; E528-A531 PolarHBondContact O-N 3.45Å; F529-A531 VanDerWaalsContact C-N 3.27Å; F529-A531 PolarHBondContact O-N 3.23Å; A531-S534 PolarHBondContact O-N 2.69Å; A531-I535 WeakPolarHBondContact O-CG1 3.43Å; A531-I535 PolarHBondContact O-N 2.82Å; A531-L594 HydrophobicContact CB-CD1 4.23Å; A531-L594 HydrophobicContact CB-CD2 4.32Å
532	A	98.9	Very high	98.7	Very high	6 Å²	6	29 Å²	29	5%	0.05	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-47.2	173.9	0	0	0	0	0	111.5	R473 L474 E528 F529 S534 I535 A536	R473-A532 HydrophobicContact CB-CB 4.35Å; L474-A532 HydrophobicContact CD2-CB 3.75Å; L474-A532 HydrophobicContact CG-CB 4.22Å; E528-A532 PolarHBondContact O-N 3.22Å; F529-A532 PolarHBondContact O-N 3.34Å; A532-S534 VanDerWaalsContact C-N 3.31Å; A532-S534 PolarHBondContact O-N 2.86Å; A532-I535 PolarHBondContact O-N 3.48Å; A532-A536 PolarHBondContact O-N 3.22Å
533	N	98.9	Very high	98.7	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58	-42.2	173.9	-76.7	-2.3	0	0	0	111.8	F529 I535 A536 A537 V590 S622 V626	F529-N533 VanDerWaalsContact CE2-OD1 3.28Å; F529-N533 WeakPolarHBondContact CE2-OD1 3.3Å; F529-N533 WeakPolarHBondContact O-CB 3.36Å; F529-N533 PolarHBondContact O-N 3.34Å; N533-I535 PolarHBondContact O-N 3.34Å; N533-A536 PolarHBondContact O-N 2.78Å; N533-A537 VanDerWaalsContact O-CB 3.3Å; N533-A537 WeakPolarHBondContact O-CB 3.03Å; N533-A537 PolarHBondContact O-N 2.84Å; N533-V590 HydrophobicContact CB-CG1 3.91Å; N533-S622 WeakPolarHBondContact CB-OG 3.42Å; N533-S622 PolarHBondContact ND2-OG 2.93Å; N533-V626 HydrophobicContact CB-CG2 3.86Å
534	S	98.9	Very high	98.7	Very high	10 Å²	10	27.4 Å²	27.4	7%	0.07	14%	0.143	C	C	.	.	H	α-helix	trans	-61.8	-42.2	176.4	-65.9	0	0	0	0	112.2	L530 A531 A532 A537 V538 V590 F591 L594	L530-S534 VanDerWaalsContact O-CB 3.32Å; L530-S534 WeakPolarHBondContact O-CB 3.33Å; L530-S534 PolarHBondContact O-N 2.77Å; L530-S534 PolarHBondContact O-OG 2.93Å; A531-S534 PolarHBondContact O-N 2.69Å; A532-S534 VanDerWaalsContact C-N 3.31Å; A532-S534 PolarHBondContact O-N 2.86Å; S534-A537 PolarHBondContact O-N 3.26Å; S534-V538 WeakPolarHBondContact O-CG2 3.36Å; S534-V538 PolarHBondContact O-N 3.44Å; S534-V590 PolarHBondContact OG-O 3.5Å; S534-F591 WeakPolarHBondContact O-CE1 3.5Å; S534-L594 WeakPolarHBondContact OG-CD2 3.41Å
535	I	98.9	Very high	98.7	Very high	61 Å²	61	25.7 Å²	25.7	31%	0.313	13%	0.131	S	C	.	.	H	α-helix	trans	-67.5	-41.9	178.2	-63.6	163.8	0	0	0	111.1	A531 A532 N533 A537 V538 H539	A531-I535 WeakPolarHBondContact O-CG1 3.43Å; A531-I535 PolarHBondContact O-N 2.82Å; A532-I535 PolarHBondContact O-N 3.48Å; N533-I535 PolarHBondContact O-N 3.34Å; I535-A537 VanDerWaalsContact C-N 3.33Å; I535-A537 PolarHBondContact O-N 3.41Å; I535-V538 WeakPolarHBondContact O-CB 3.34Å; I535-V538 PolarHBondContact O-N 2.96Å; I535-H539 PolarHBondContact O-N 3.41Å; I535-H539 VanDerWaalsContact O-N 3.13Å
536	A	98.9	Very high	98.6	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-60.1	-43.2	173.3	0	0	0	0	0	111.9	D470 A532 N533 V538 H539 L540	D470-A536 HydrophobicContact CB-CB 4.12Å; D470-A536 WeakPolarHBondContact OD2-CA 3.43Å; A532-A536 PolarHBondContact O-N 3.22Å; N533-A536 PolarHBondContact O-N 2.78Å; A536-V538 VanDerWaalsContact C-N 3.3Å; A536-V538 PolarHBondContact O-N 3.12Å; A536-H539 PolarHBondContact O-N 3.33Å; A536-H539 VanDerWaalsContact O-N 3.14Å; A536-L540 WeakPolarHBondContact O-CB 3.3Å; A536-L540 VanDerWaalsContact O-CG 3.29Å; A536-L540 WeakPolarHBondContact O-CG 3.36Å; A536-L540 PolarHBondContact O-N 2.87Å
537	A	98.8	Very high	98.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.6	-31.7	176.3	0	0	0	0	0	113	N533 S534 I535 S541 V590 F591 M629	N533-A537 VanDerWaalsContact O-CB 3.3Å; N533-A537 WeakPolarHBondContact O-CB 3.03Å; N533-A537 PolarHBondContact O-N 2.84Å; S534-A537 PolarHBondContact O-N 3.26Å; I535-A537 VanDerWaalsContact C-N 3.33Å; I535-A537 PolarHBondContact O-N 3.41Å; A537-S541 WeakPolarHBondContact O-CB 3.49Å; A537-S541 PolarHBondContact O-N 3.18Å; A537-V590 HydrophobicContact CB-CB 4Å; A537-V590 HydrophobicContact CB-CG1 4Å; A537-V590 HydrophobicContact CB-CG2 4.1Å; A537-F591 HydrophobicContact CB-CE1 4.04Å; A537-M629 HydrophobicContact CB-CE 3.93Å
538	V	98.8	Very high	98.6	Very high	61 Å²	61	27 Å²	27	37%	0.37	14%	0.138	S	C	.	.	H	α-helix	trans	-62.5	-52.8	168.4	172	0	0	0	0	110.4	S534 I535 A536 L540 S541 R542 F591	S534-V538 WeakPolarHBondContact O-CG2 3.36Å; S534-V538 PolarHBondContact O-N 3.44Å; I535-V538 WeakPolarHBondContact O-CB 3.34Å; I535-V538 PolarHBondContact O-N 2.96Å; A536-V538 VanDerWaalsContact C-N 3.3Å; A536-V538 PolarHBondContact O-N 3.12Å; V538-L540 VanDerWaalsContact C-N 3.33Å; V538-L540 PolarHBondContact O-N 3.11Å; V538-S541 PolarHBondContact O-N 2.85Å; V538-S541 VanDerWaalsContact O-N 3.1Å; V538-S541 PolarHBondContact O-OG 2.71Å; V538-R542 WeakPolarHBondContact O-CG 3.42Å; V538-R542 PolarHBondContact O-N 3.17Å; V538-R542 VanDerWaalsContact O-N 3.13Å; V538-F591 HydrophobicContact CG2-CE1 3.71Å; V538-F591 HydrophobicContact CG2-CZ 3.52Å
539	H	98.8	Very high	98.5	Very high	28 Å²	28	26.5 Å²	26.5	13%	0.13	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-40.5	-178.6	-61.6	145.2	0	0	0	112.6	Q466 D470 I535 A536 S541 R542 I543	Q466-H539 HydrophobicContact CB-CB 4.11Å; Q466-H539 PolarHBondContact OE1-CD2 3.07Å; D470-H539 VanDerWaalsContact CG-ND1 3.25Å; D470-H539 IonicContact OD1-CE1 2.73Å; D470-H539 PolarHBondContact OD1-CE1 3.37Å; D470-H539 IonicContact OD1-ND1 4Å; D470-H539 PolarHBondContact OD1-ND1 2.82Å; D470-H539 IonicContact OD2-CE1 2.75Å; D470-H539 IonicContact OD2-CG 3.79Å; D470-H539 IonicContact OD2-ND1 2.68Å; D470-H539 PolarHBondContact OD2-ND1 2.58Å; I535-H539 PolarHBondContact O-N 3.41Å; I535-H539 VanDerWaalsContact O-N 3.13Å; A536-H539 PolarHBondContact O-N 3.33Å; A536-H539 VanDerWaalsContact O-N 3.14Å; H539-S541 VanDerWaalsContact C-N 3.35Å; H539-S541 PolarHBondContact O-N 2.76Å; H539-R542 WeakPolarHBondContact O-CB 3.32Å; H539-R542 PolarHBondContact O-N 3.06Å; H539-R542 VanDerWaalsContact O-N 3.16Å; H539-I543 PolarHBondContact O-N 2.89Å
540	L	98.8	Very high	98.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-36.5	174.7	-65.9	166.8	0	0	0	111.9	F426 L467 A536 V538 R542 I543 G544 V583 M629 L630 C633	F426-L540 HydrophobicContact CD1-CD2 3.97Å; F426-L540 HydrophobicContact CE1-CD2 3.59Å; L467-L540 HydrophobicContact CD2-CD2 4.38Å; A536-L540 WeakPolarHBondContact O-CB 3.3Å; A536-L540 VanDerWaalsContact O-CG 3.29Å; A536-L540 WeakPolarHBondContact O-CG 3.36Å; A536-L540 PolarHBondContact O-N 2.87Å; V538-L540 VanDerWaalsContact C-N 3.33Å; V538-L540 PolarHBondContact O-N 3.11Å; L540-R542 VanDerWaalsContact C-N 3.28Å; L540-R542 PolarHBondContact O-N 3.33Å; L540-I543 WeakPolarHBondContact O-CG2 3.38Å; L540-G544 PolarHBondContact O-N 3.09Å; L540-G544 VanDerWaalsContact O-N 3.08Å; L540-V583 HydrophobicContact CB-CG1 3.95Å; L540-V583 WeakPolarHBondContact O-CG1 3.44Å; L540-M629 HydrophobicContact CB-CE 3.74Å; L540-M629 HydrophobicContact CD1-CB 3.98Å; L540-M629 HydrophobicContact CD1-CE 4.06Å; L540-L630 HydrophobicContact CD1-CD2 3.97Å; L540-L630 HydrophobicContact CD1-CG 4.04Å; L540-L630 HydrophobicContact CD2-CD2 3.95Å; L540-C633 HydrophobicContact CD2-CB 4.37Å
541	S	98.7	Very high	98.4	Very high	23 Å²	23	27.8 Å²	27.8	16%	0.161	15%	0.146	C	C	.	.	H	α-helix	trans	-65.3	-30.1	173.6	77.3	0	0	0	0	113.1	A537 V538 H539 G544 E545	A537-S541 WeakPolarHBondContact O-CB 3.49Å; A537-S541 PolarHBondContact O-N 3.18Å; V538-S541 PolarHBondContact O-N 2.85Å; V538-S541 VanDerWaalsContact O-N 3.1Å; V538-S541 PolarHBondContact O-OG 2.71Å; H539-S541 VanDerWaalsContact C-N 3.35Å; H539-S541 PolarHBondContact O-N 2.76Å; S541-G544 PolarHBondContact O-N 3.38Å; S541-E545 PolarHBondContact O-N 2.96Å
542	R	98.5	Very high	98.3	Very high	140 Å²	140	27.7 Å²	27.7	53%	0.528	14%	0.144	S	C	.	.	H	α-helix	trans	-70.3	-41.2	178.1	-65.4	179.6	71	-159.5	5.1	113.1	Y463 V538 H539 L540 G544 E545 E546	Y463-R542 HydrophobicContact CE1-CB 4.4Å; V538-R542 WeakPolarHBondContact O-CG 3.42Å; V538-R542 PolarHBondContact O-N 3.17Å; V538-R542 VanDerWaalsContact O-N 3.13Å; H539-R542 WeakPolarHBondContact O-CB 3.32Å; H539-R542 PolarHBondContact O-N 3.06Å; H539-R542 VanDerWaalsContact O-N 3.16Å; L540-R542 VanDerWaalsContact C-N 3.28Å; L540-R542 PolarHBondContact O-N 3.33Å; R542-G544 VanDerWaalsContact C-N 3.31Å; R542-E545 PolarHBondContact O-N 2.98Å; R542-E546 PolarHBondContact O-N 3.21Å; R542-E546 VanDerWaalsContact O-N 3.16Å
543	I	98.1	Very high	98.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-73.1	-29.1	174.2	-158	171	0	0	0	111.3	F426 L430 Y463 H539 L540 E546 W547 M580	F426-I543 HydrophobicContact CZ-CD1 4.04Å; F426-I543 HydrophobicContact CZ-CG2 4.27Å; L430-I543 HydrophobicContact CD2-CD1 3.9Å; Y463-I543 HydrophobicContact CD1-CB 3.76Å; Y463-I543 HydrophobicContact CD1-CD1 4.09Å; Y463-I543 HydrophobicContact CD1-CG1 4.12Å; Y463-I543 HydrophobicContact CD2-CD1 3.67Å; Y463-I543 HydrophobicContact CD2-CG1 4.11Å; Y463-I543 HydrophobicContact CE1-CB 3.54Å; Y463-I543 HydrophobicContact CE1-CD1 4.35Å; Y463-I543 HydrophobicContact CE1-CG1 3.91Å; Y463-I543 HydrophobicContact CE2-CB 4.46Å; Y463-I543 HydrophobicContact CE2-CD1 3.95Å; Y463-I543 HydrophobicContact CE2-CG1 3.9Å; Y463-I543 HydrophobicContact CG-CB 4.31Å; Y463-I543 HydrophobicContact CG-CD1 3.73Å; Y463-I543 HydrophobicContact CG-CG1 4.21Å; H539-I543 PolarHBondContact O-N 2.89Å; L540-I543 WeakPolarHBondContact O-CG2 3.38Å; I543-E546 PolarHBondContact O-N 3.33Å; I543-W547 HydrophobicContact CD1-CD2 4.33Å; I543-W547 HydrophobicContact CD1-CH2 3.68Å; I543-W547 HydrophobicContact CD1-CZ2 3.31Å; I543-W547 HydrophobicContact CD1-CZ3 4.32Å; I543-W547 HydrophobicContact CG1-CD2 3.89Å; I543-W547 HydrophobicContact CG1-CE3 4.33Å; I543-W547 HydrophobicContact CG1-CG 4.35Å; I543-W547 HydrophobicContact CG1-CH2 4.25Å; I543-W547 HydrophobicContact CG1-CZ2 3.82Å; I543-W547 HydrophobicContact CG1-CZ3 4.49Å; I543-W547 WeakPolarHBondContact O-CB 3.48Å; I543-W547 PolarHBondContact O-N 3.44Å; I543-M580 HydrophobicContact CG2-CE 4.1Å
544	G	97.8	Very high	98	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.1	-48.7	167.3	0	0	0	0	0	113.1	L540 S541 R542 V548	L540-G544 PolarHBondContact O-N 3.09Å; L540-G544 VanDerWaalsContact O-N 3.08Å; S541-G544 PolarHBondContact O-N 3.38Å; R542-G544 VanDerWaalsContact C-N 3.31Å; G544-V548 WeakPolarHBondContact O-CB 3.41Å; G544-V548 WeakPolarHBondContact O-CG2 3.5Å; G544-V548 PolarHBondContact O-N 3.3Å
545	E	98.3	Very high	97.8	Very high	79 Å²	79	42.6 Å²	42.6	37%	0.369	21%	0.211	S	C	.	.	H	α-helix	trans	-59	-50.1	175.4	-166	66.4	-130.9	0	0	111.9	S541 R542 W547 V548 L549 R584	S541-E545 PolarHBondContact O-N 2.96Å; R542-E545 PolarHBondContact O-N 2.98Å; E545-W547 PolarHBondContact O-N 2.82Å; E545-V548 PolarHBondContact O-N 3.45Å; E545-L549 HydrophobicContact CG-CD1 4.13Å; E545-L549 WeakPolarHBondContact O-CB 3.45Å; E545-L549 WeakPolarHBondContact O-CG 3.34Å; E545-L549 PolarHBondContact O-N 3.34Å; E545-R584 IonicContact OE1-NH1 3.67Å; E545-R584 PolarHBondContact OE1-NH1 3.22Å; E545-R584 WeakPolarHBondContact OE2-CD 3.36Å; E545-R584 IonicContact OE2-CZ 2.67Å; E545-R584 IonicContact OE2-NE 2.66Å; E545-R584 IonicContact OE2-NH1 3.7Å; E545-R584 PolarHBondContact OE2-NH1 2.97Å
546	E	97.8	Very high	97.7	Very high	39 Å²	39	40.4 Å²	40.4	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-47.9	-177.7	-157.6	73.4	-132.8	0	0	111.8	Y463 R542 I543 L549 W550	Y463-E546 WeakPolarHBondContact OH-CB 3.35Å; R542-E546 PolarHBondContact O-N 3.21Å; R542-E546 VanDerWaalsContact O-N 3.16Å; I543-E546 PolarHBondContact O-N 3.33Å; E546-L549 PolarHBondContact O-N 3.08Å; E546-W550 HydrophobicContact CG-CZ2 4.28Å; E546-W550 WeakPolarHBondContact O-CB 3.32Å; E546-W550 VanDerWaalsContact O-CG 3.3Å; E546-W550 PolarHBondContact O-N 3.28Å; E546-W550 PolarHBondContact OE1-NE1 3.38Å
547	W	97.9	Very high	97.7	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-72.2	-30.7	-179.3	-69.4	-6.6	0	0	0	113.5	F426 L430 I543 E545 A551 L558 M580 F636 A637 I640	F426-W547 HydrophobicContact CE2-CH2 4.2Å; F426-W547 HydrophobicContact CZ-CH2 4.44Å; L430-W547 HydrophobicContact CD2-CH2 4.18Å; L430-W547 HydrophobicContact CD2-CZ2 4.04Å; I543-W547 HydrophobicContact CD1-CD2 4.33Å; I543-W547 HydrophobicContact CD1-CH2 3.68Å; I543-W547 HydrophobicContact CD1-CZ2 3.31Å; I543-W547 HydrophobicContact CD1-CZ3 4.32Å; I543-W547 HydrophobicContact CG1-CD2 3.89Å; I543-W547 HydrophobicContact CG1-CE3 4.33Å; I543-W547 HydrophobicContact CG1-CG 4.35Å; I543-W547 HydrophobicContact CG1-CH2 4.25Å; I543-W547 HydrophobicContact CG1-CZ2 3.82Å; I543-W547 HydrophobicContact CG1-CZ3 4.49Å; I543-W547 WeakPolarHBondContact O-CB 3.48Å; I543-W547 PolarHBondContact O-N 3.44Å; E545-W547 PolarHBondContact O-N 2.82Å; W547-A551 VanDerWaalsContact O-CB 3.26Å; W547-A551 WeakPolarHBondContact O-CB 3.32Å; W547-A551 PolarHBondContact O-N 2.88Å; W547-A551 VanDerWaalsContact O-N 3.11Å; W547-L558 HydrophobicContact CB-CD1 4.1Å; W547-L558 HydrophobicContact CD2-CD1 4.34Å; W547-L558 HydrophobicContact CG-CD1 3.77Å; W547-M580 HydrophobicContact CD2-CE 4.47Å; W547-M580 HydrophobicContact CE3-CE 3.53Å; W547-M580 HydrophobicContact CE3-CG 4.11Å; W547-M580 HydrophobicContact CE3-SD 3.77Å; W547-M580 HydrophobicContact CZ3-CE 3.95Å; W547-M580 HydrophobicContact CZ3-SD 4.09Å; W547-F636 HydrophobicContact CB-CE1 4.04Å; W547-F636 HydrophobicContact CD2-CD1 4.04Å; W547-F636 HydrophobicContact CD2-CE1 4.02Å; W547-F636 AromaticContact CE3-CD1 3.21Å; W547-F636 HydrophobicContact CE3-CD1 3.21Å; W547-F636 AromaticContact CE3-CE1 3.57Å; W547-F636 HydrophobicContact CE3-CE1 3.57Å; W547-F636 HydrophobicContact CE3-CG 4.13Å; W547-F636 HydrophobicContact CG-CE1 4.27Å; W547-F636 HydrophobicContact CZ3-CB 4.15Å; W547-F636 AromaticContact CZ3-CD1 3.53Å; W547-F636 HydrophobicContact CZ3-CD1 3.53Å; W547-F636 HydrophobicContact CZ3-CE1 4.33Å; W547-F636 HydrophobicContact CZ3-CG 4.23Å; W547-A637 HydrophobicContact CH2-CB 3.84Å; W547-I640 HydrophobicContact CD2-CD1 4.43Å; W547-I640 HydrophobicContact CH2-CD1 4.31Å; W547-I640 HydrophobicContact CZ2-CD1 3.96Å
548	V	97.9	Very high	97.6	Very high	22 Å²	22	40.5 Å²	40.5	13%	0.133	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-44	170.8	171.6	0	0	0	0	110.7	G544 E545 P577 M580 E581	G544-V548 WeakPolarHBondContact O-CB 3.41Å; G544-V548 WeakPolarHBondContact O-CG2 3.5Å; G544-V548 PolarHBondContact O-N 3.3Å; E545-V548 PolarHBondContact O-N 3.45Å; V548-P577 HydrophobicContact CB-CG 4.26Å; V548-P577 HydrophobicContact CG1-CG 4.26Å; V548-P577 HydrophobicContact CG2-CB 4.32Å; V548-P577 HydrophobicContact CG2-CG 3.9Å; V548-M580 HydrophobicContact CG2-CB 4Å; V548-E581 HydrophobicContact CG1-CG 4.41Å; V548-E581 HydrophobicContact CG2-CG 3.79Å
549	L	97.9	Very high	97.5	Very high	45 Å²	45	40.1 Å²	40.1	24%	0.236	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-45.4	175.7	-73	169.4	0	0	0	111.8	L448 E545 E546 A551 S552	L448-L549 HydrophobicContact CD1-CD1 4.17Å; L448-L549 HydrophobicContact CD2-CD1 4.46Å; E545-L549 HydrophobicContact CG-CD1 4.13Å; E545-L549 WeakPolarHBondContact O-CB 3.45Å; E545-L549 WeakPolarHBondContact O-CG 3.34Å; E545-L549 PolarHBondContact O-N 3.34Å; E546-L549 PolarHBondContact O-N 3.08Å; L549-A551 VanDerWaalsContact C-N 3.29Å; L549-A551 PolarHBondContact O-N 2.95Å; L549-S552 VanDerWaalsContact O-CB 3.27Å; L549-S552 WeakPolarHBondContact O-CB 3.26Å; L549-S552 PolarHBondContact O-N 2.9Å; L549-S552 VanDerWaalsContact O-N 3.17Å; L549-S552 PolarHBondContact O-OG 2.9Å
550	W	98	Very high	97.4	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.015	20%	0.197	C	C	.	.	H	α-helix	trans	-71.8	-21.7	-176.3	-74.2	32.2	0	0	0	114	V442 L456 L459 E546 S552 F555 F557 L558 F642	V442-W550 HydrophobicContact CB-CH2 4.44Å; V442-W550 HydrophobicContact CG1-CH2 4.23Å; V442-W550 HydrophobicContact CG1-CZ3 4.41Å; V442-W550 HydrophobicContact CG2-CH2 4.29Å; L456-W550 HydrophobicContact CD1-CH2 3.81Å; L456-W550 HydrophobicContact CD1-CZ3 3.69Å; L459-W550 HydrophobicContact CD2-CH2 3.5Å; L459-W550 HydrophobicContact CD2-CZ2 3.49Å; L459-W550 VanDerWaalsContact CD2-CZ2 3.49Å; E546-W550 HydrophobicContact CG-CZ2 4.28Å; E546-W550 WeakPolarHBondContact O-CB 3.32Å; E546-W550 VanDerWaalsContact O-CG 3.3Å; E546-W550 PolarHBondContact O-N 3.28Å; E546-W550 PolarHBondContact OE1-NE1 3.38Å; W550-S552 VanDerWaalsContact C-N 3.35Å; W550-F555 AromaticContact CD1-CD1 3.98Å; W550-F557 HydrophobicContact CB-CB 4.11Å; W550-F557 HydrophobicContact CD2-CB 4.08Å; W550-F557 AromaticContact CD2-CD2 3.97Å; W550-F557 HydrophobicContact CD2-CD2 3.97Å; W550-F557 HydrophobicContact CE3-CB 3.89Å; W550-F557 HydrophobicContact CE3-CD2 4.26Å; W550-F557 HydrophobicContact CG-CB 4.18Å; W550-F557 HydrophobicContact CG-CD2 4.24Å; W550-F557 PolarHBondContact O-N 2.9Å; W550-L558 HydrophobicContact CB-CB 3.82Å; W550-L558 PolarHBondContact O-N 3.01Å; W550-F642 HydrophobicContact CE3-CD1 4.03Å; W550-F642 AromaticContact CE3-CE1 3.67Å; W550-F642 HydrophobicContact CE3-CE1 3.67Å; W550-F642 AromaticContact CZ3-CD1 3.97Å; W550-F642 HydrophobicContact CZ3-CD1 3.97Å; W550-F642 AromaticContact CZ3-CE1 3.59Å; W550-F642 HydrophobicContact CZ3-CE1 3.59Å
551	A	97	Very high	97.1	Very high	23 Å²	23	40.6 Å²	40.6	19%	0.19	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.7	172.8	0	0	0	0	0	114.2	W547 L549 L558 P577	W547-A551 VanDerWaalsContact O-CB 3.26Å; W547-A551 WeakPolarHBondContact O-CB 3.32Å; W547-A551 PolarHBondContact O-N 2.88Å; W547-A551 VanDerWaalsContact O-N 3.11Å; L549-A551 VanDerWaalsContact C-N 3.29Å; L549-A551 PolarHBondContact O-N 2.95Å; A551-L558 HydrophobicContact CB-CD2 3.99Å; A551-P577 HydrophobicContact CB-CB 4.43Å; A551-P577 HydrophobicContact CB-CG 4.2Å
552	S	97.3	Very high	96.8	Very high	32 Å²	32	45.7 Å²	45.7	22%	0.224	23%	0.233	C	C	.	.	S	Bend	trans	-65.1	158.6	173	67.7	0	0	0	0	112.2	L549 W550 E554 F555 G556	L549-S552 VanDerWaalsContact O-CB 3.27Å; L549-S552 WeakPolarHBondContact O-CB 3.26Å; L549-S552 PolarHBondContact O-N 2.9Å; L549-S552 VanDerWaalsContact O-N 3.17Å; L549-S552 PolarHBondContact O-OG 2.9Å; W550-S552 VanDerWaalsContact C-N 3.35Å; S552-E554 VanDerWaalsContact C-N 3.27Å; S552-E554 PolarHBondContact O-N 3.11Å; S552-F555 WeakPolarHBondContact OG-CD2 3.2Å; S552-F555 PolarHBondContact OG-N 2.97Å; S552-F555 VanDerWaalsContact OG-N 3.16Å; S552-G556 VanDerWaalsContact O-CA 3.31Å; S552-G556 WeakPolarHBondContact O-CA 3.33Å; S552-G556 PolarHBondContact O-N 2.83Å
553	E	94.5	Very high	96.6	Very high	142 Å²	142	42.6 Å²	42.6	66%	0.664	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-29.4	174.2	-178.8	64.6	-137.7	0	0	111.3	R646	E553-R646 PolarHBondContact O-NH2 3.13Å
554	E	95.8	Very high	96.3	Very high	155 Å²	155	42.8 Å²	42.8	72%	0.724	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-43.7	177.6	-69	74.7	-170.1	0	0	111.7	S552 R646	S552-E554 VanDerWaalsContact C-N 3.27Å; S552-E554 PolarHBondContact O-N 3.11Å; E554-R646 PolarHBondContact O-NH2 2.81Å
555	F	96.5	Very high	96.1	Very high	32 Å²	32	43.3 Å²	43.3	14%	0.14	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-62	172.6	-76.6	-114.8	0	0	0	110.6	Y445 L448 W550 S552 F557 R646	Y445-F555 HydrophobicContact CE1-CE1 4.17Å; Y445-F555 HydrophobicContact CE2-CE1 4.17Å; Y445-F555 AromaticContact CZ-CE1 3.67Å; Y445-F555 WeakPolarHBondContact OH-CE1 3.27Å; L448-F555 HydrophobicContact CD1-CZ 4.03Å; L448-F555 HydrophobicContact CG-CZ 4.41Å; W550-F555 AromaticContact CD1-CD1 3.98Å; S552-F555 WeakPolarHBondContact OG-CD2 3.2Å; S552-F555 PolarHBondContact OG-N 2.97Å; S552-F555 VanDerWaalsContact OG-N 3.16Å; F555-F557 HydrophobicContact CB-CD1 4.43Å; F555-F557 HydrophobicContact CB-CD2 4.5Å; F555-F557 HydrophobicContact CB-CG 4.28Å; F555-F557 AromaticContact CD1-CD2 3.92Å; F555-F557 HydrophobicContact CD1-CD2 3.92Å; F555-F557 AromaticContact CD1-CE2 3.85Å; F555-F557 HydrophobicContact CD1-CE2 3.85Å; F555-F557 HydrophobicContact CD1-CZ 4.4Å; F555-F557 WeakPolarHBondContact O-CD1 3.2Å; F555-F557 WeakPolarHBondContact O-CE1 3.37Å; F555-F557 PolarHBondContact O-N 3.23Å; F555-R646 VanDerWaalsContact O-CG 3.27Å; F555-R646 WeakPolarHBondContact O-CG 3.35Å; F555-R646 PolarHBondContact O-NE 3.33Å; F555-R646 PolarHBondContact O-NH2 2.99Å
556	G	96.4	Very high	95.7	Very high	14 Å²	14	42.4 Å²	42.4	14%	0.144	24%	0.237	C	C	.	.			trans	66.2	22.1	-177	0	0	0	0	0	113.9	S552 N643 R646	S552-G556 VanDerWaalsContact O-CA 3.31Å; S552-G556 WeakPolarHBondContact O-CA 3.33Å; S552-G556 PolarHBondContact O-N 2.83Å; G556-N643 WeakPolarHBondContact O-CB 3.15Å; G556-N643 PolarHBondContact O-ND2 3.34Å; G556-R646 WeakPolarHBondContact O-CG 3.4Å
557	F	98	Very high	95.1	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	26%	0.259	C	S	.	.			trans	-81.6	-33.7	-173.8	-70	-3.3	0	0	0	112.6	P443 Y445 W550 F555 F642 N643 R646 I647 S650	P443-F557 HydrophobicContact CG-CE2 3.75Å; P443-F557 HydrophobicContact CG-CZ 3.78Å; Y445-F557 HydrophobicContact CE2-CE2 4.22Å; Y445-F557 WeakPolarHBondContact OH-CE2 3.48Å; W550-F557 HydrophobicContact CB-CB 4.11Å; W550-F557 HydrophobicContact CD2-CB 4.08Å; W550-F557 AromaticContact CD2-CD2 3.97Å; W550-F557 HydrophobicContact CD2-CD2 3.97Å; W550-F557 HydrophobicContact CE3-CB 3.89Å; W550-F557 HydrophobicContact CE3-CD2 4.26Å; W550-F557 HydrophobicContact CG-CB 4.18Å; W550-F557 HydrophobicContact CG-CD2 4.24Å; W550-F557 PolarHBondContact O-N 2.9Å; F555-F557 HydrophobicContact CB-CD1 4.43Å; F555-F557 HydrophobicContact CB-CD2 4.5Å; F555-F557 HydrophobicContact CB-CG 4.28Å; F555-F557 AromaticContact CD1-CD2 3.92Å; F555-F557 HydrophobicContact CD1-CD2 3.92Å; F555-F557 AromaticContact CD1-CE2 3.85Å; F555-F557 HydrophobicContact CD1-CE2 3.85Å; F555-F557 HydrophobicContact CD1-CZ 4.4Å; F555-F557 WeakPolarHBondContact O-CD1 3.2Å; F555-F557 WeakPolarHBondContact O-CE1 3.37Å; F555-F557 PolarHBondContact O-N 3.23Å; F557-F642 CarbonylContact O-C 3.56Å; F557-F642 VanDerWaalsContact O-CA 3.3Å; F557-F642 WeakPolarHBondContact O-CA 3.32Å; F557-N643 PolarHBondContact O-N 2.84Å; F557-R646 HydrophobicContact CD1-CG 4.22Å; F557-I647 HydrophobicContact CB-CD1 4.21Å; F557-I647 HydrophobicContact CB-CG1 3.9Å; F557-I647 HydrophobicContact CD1-CG1 3.65Å; F557-I647 HydrophobicContact CD2-CG1 4.42Å; F557-I647 HydrophobicContact CE1-CG1 4.27Å; F557-I647 HydrophobicContact CG-CG1 3.74Å; F557-S650 WeakPolarHBondContact CZ-OG 3.38Å
558	L	97.1	Very high	94.5	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144.2	-178.2	179.4	151.8	0	0	0	109.4	W547 W550 A551 F636 I640 F642	W547-L558 HydrophobicContact CB-CD1 4.1Å; W547-L558 HydrophobicContact CD2-CD1 4.34Å; W547-L558 HydrophobicContact CG-CD1 3.77Å; W550-L558 HydrophobicContact CB-CB 3.82Å; W550-L558 PolarHBondContact O-N 3.01Å; A551-L558 HydrophobicContact CB-CD2 3.99Å; L558-F636 HydrophobicContact CD1-CE1 4.39Å; L558-F636 HydrophobicContact CD2-CE1 4.08Å; L558-F636 HydrophobicContact CD2-CZ 4.24Å; L558-I640 HydrophobicContact CD1-CB 4.34Å; L558-I640 HydrophobicContact CD1-CD1 3.69Å; L558-I640 HydrophobicContact CD1-CG2 4.15Å; L558-I640 HydrophobicContact CD2-CG2 3.84Å; L558-I640 HydrophobicContact CG-CB 4.25Å; L558-I640 HydrophobicContact CG-CD1 4.49Å; L558-I640 HydrophobicContact CG-CG2 4.07Å; L558-F642 HydrophobicContact CB-CD1 4.29Å; L558-F642 HydrophobicContact CB-CE1 4.26Å; L558-F642 HydrophobicContact CD1-CE1 3.87Å; L558-F642 HydrophobicContact CD1-CZ 4.27Å; L558-F642 HydrophobicContact CG-CE1 4.38Å
559	T	96.1	Very high	94	Very high	54 Å²	54	49.9 Å²	49.9	33%	0.331	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	116.4	173.1	-59.5	0	0	0	0	109.5	S641	T559-S641 PolarHBondContact N-O 2.88Å; T559-S641 PolarHBondContact O-N 3.33Å; T559-S641 PolarHBondContact O-OG 3.4Å
560	P	96.3	Very high	93.5	Very high	8 Å²	8	54.6 Å²	54.6	5%	0.052	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	155.7	176.2	31.9	-33.8	0	0	0	112.3	V564 K575 F636 I640	P560-V564 HydrophobicContact CB-CG2 3.85Å; P560-K575 HydrophobicContact CG-CB 4.09Å; P560-K575 HydrophobicContact CG-CD 4.11Å; P560-K575 VanDerWaalsContact O-CD 3.27Å; P560-K575 WeakPolarHBondContact O-CD 3.27Å; P560-K575 PolarHBondContact O-NZ 3.04Å; P560-F636 HydrophobicContact CB-CE2 4.25Å; P560-F636 HydrophobicContact CB-CZ 4.17Å; P560-I640 HydrophobicContact CB-CG2 4.32Å
561	S	94.4	Very high	93.1	Very high	31 Å²	31	58.3 Å²	58.3	22%	0.217	35%	0.348	C	S	.	.			trans	-64.6	171.2	164.9	79.6	0	0	0	0	111.5	S563 V564 S565 N639	S561-S563 VanDerWaalsContact C-N 3.25Å; S561-S563 PolarHBondContact O-N 3.38Å; S561-S563 PolarHBondContact OG-N 3.47Å; S561-S563 VanDerWaalsContact OG-N 3.08Å; S561-S563 PolarHBondContact OG-OG 2.88Å; S561-V564 PolarHBondContact OG-N 2.9Å; S561-S565 PolarHBondContact O-N 3.46Å; S561-S565 PolarHBondContact O-OG 2.93Å; S561-N639 WeakPolarHBondContact CB-O 3.37Å; S561-N639 PolarHBondContact N-O 3.34Å
562	D	92.2	Very high	92.6	Very high	130 Å²	130	62.8 Å²	62.8	70%	0.695	38%	0.375	S	S	*	.	S	Bend	trans	-78.4	-5.8	172.2	-58.3	-27.2	0	0	0	113.2	K575	D562-K575 WeakPolarHBondContact OD1-CE 3.42Å; D562-K575 IonicContact OD1-NZ 3.55Å; D562-K575 PolarHBondContact OD1-NZ 3.3Å
563	S	92.9	Very high	92.1	Very high	74 Å²	74	67.9 Å²	67.9	52%	0.517	40%	0.395	S	S	.	.	S	Bend	trans	-83.6	-36.2	171.8	57.7	0	0	0	0	112.2	S561 N639	S561-S563 VanDerWaalsContact C-N 3.25Å; S561-S563 PolarHBondContact O-N 3.38Å; S561-S563 PolarHBondContact OG-N 3.47Å; S561-S563 VanDerWaalsContact OG-N 3.08Å; S561-S563 PolarHBondContact OG-OG 2.88Å; S563-N639 PolarHBondContact OG-OD1 3.22Å
564	V	93	Very high	91.9	Very high	5 Å²	5	66 Å²	66	3%	0.03	39%	0.385	C	S	.	.	S	Bend	trans	-104.9	19.5	-176.9	-53.2	0	0	0	0	113.8	P560 S561 P579 E635 F636 N639	P560-V564 HydrophobicContact CB-CG2 3.85Å; S561-V564 PolarHBondContact OG-N 2.9Å; V564-P579 WeakPolarHBondContact O-CD 3.32Å; V564-P579 WeakPolarHBondContact O-CG 3.45Å; V564-E635 HydrophobicContact CG1-CB 4.47Å; V564-E635 HydrophobicContact CG1-CG 3.81Å; V564-F636 HydrophobicContact CB-CD2 3.73Å; V564-F636 HydrophobicContact CB-CE2 4.36Å; V564-F636 HydrophobicContact CB-CG 4.37Å; V564-F636 HydrophobicContact CG2-CD2 3.67Å; V564-F636 HydrophobicContact CG2-CE2 4.03Å; V564-F636 HydrophobicContact CG2-CG 4.14Å; V564-F636 WeakPolarHBondContact O-CE2 3.23Å; V564-N639 HydrophobicContact CB-CB 4.33Å; V564-N639 HydrophobicContact CG1-CB 3.62Å; V564-N639 HydrophobicContact CG2-CB 3.71Å
565	S	93.3	Very high	91.8	Very high	11 Å²	11	61.5 Å²	61.5	8%	0.077	36%	0.363	C	S	.	.	S	Bend	trans	-148.1	156.6	174.1	66.8	0	0	0	0	112.1	S561 N576	S561-S565 PolarHBondContact O-N 3.46Å; S561-S565 PolarHBondContact O-OG 2.93Å; S565-N576 WeakPolarHBondContact CA-O 3.47Å; S565-N576 WeakPolarHBondContact CB-O 3Å
566	T	90.1	Very high	91.7	Very high	60 Å²	60	61.7 Å²	61.7	37%	0.368	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.2	172	69.3	0	0	0	0	111	N576 D578	T566-N576 PolarHBondContact N-O 3.05Å; T566-N576 PolarHBondContact O-N 3.18Å; T566-N576 PolarHBondContact O-ND2 3.4Å; T566-N576 VanDerWaalsContact O-ND2 3.11Å; T566-N576 PolarHBondContact OG1-ND2 3.33Å; T566-D578 WeakPolarHBondContact CB-OD2 2.75Å; T566-D578 HydrophobicContact CG2-CB 4.34Å; T566-D578 WeakPolarHBondContact CG2-OD2 3.38Å; T566-D578 PolarHBondContact OG1-OD2 2.81Å
567	G	84.5	Confident	91.7	Very high	62 Å²	62	61.6 Å²	61.6	64%	0.639	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	150.8	178.9	0	0	0	0	0	113.1	K574	G567-K574 WeakPolarHBondContact CA-O 3.47Å
568	S	85.7	Confident	91.6	Very high	31 Å²	31	64 Å²	64	22%	0.217	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-83.1	127.9	165	-177.4	0	0	0	0	111.3	I570 M571 K574	S568-I570 PolarHBondContact O-N 3.49Å; S568-I570 VanDerWaalsContact O-N 3.07Å; S568-I570 PolarHBondContact OG-N 3.16Å; S568-M571 CarbonylContact O-C 3.54Å; S568-M571 PolarHBondContact O-N 2.82Å; S568-M571 PolarHBondContact OG-N 3.39Å; S568-K574 PolarHBondContact N-O 3.23Å
569	S	87.7	Confident	91.5	Very high	129 Å²	129	65.3 Å²	65.3	90%	0.902	38%	0.384	S	S	*	.	S	Bend	trans	-63.7	-10.6	174.9	56.1	0	0	0	0	115
570	I	87	Confident	91.6	Very high	145 Å²	145	62.7 Å²	62.7	74%	0.744	37%	0.368	S	S	*	.	S	Bend	trans	-109.8	-28.8	178	-59.9	175.6	0	0	0	111.5	S568	S568-I570 PolarHBondContact O-N 3.49Å; S568-I570 VanDerWaalsContact O-N 3.07Å; S568-I570 PolarHBondContact OG-N 3.16Å
571	M	90.6	Very high	91.7	Very high	82 Å²	82	66.6 Å²	66.6	40%	0.404	39%	0.385	S	S	.	.			trans	-124.6	86.2	-173.9	-63.9	173.2	-72.9	0	0	109	S568 Q573 K574	S568-M571 CarbonylContact O-C 3.54Å; S568-M571 PolarHBondContact O-N 2.82Å; S568-M571 PolarHBondContact OG-N 3.39Å; M571-Q573 VanDerWaalsContact C-OE1 3.25Å; M571-Q573 PolarHBondContact O-N 2.88Å; M571-Q573 VanDerWaalsContact O-N 3.12Å; M571-K574 HydrophobicContact CB-CB 3.96Å; M571-K574 HydrophobicContact CE-CD 4.07Å; M571-K574 WeakPolarHBondContact O-CB 3.3Å; M571-K574 PolarHBondContact O-N 2.81Å
572	P	84.8	Confident	91.9	Very high	117 Å²	117	70.3 Å²	70.3	76%	0.76	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-17.7	-170.9	27.1	-35.8	0	0	0	114
573	Q	86.7	Confident	92.2	Very high	139 Å²	139	64.2 Å²	64.2	65%	0.65	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-17.9	172.6	82.8	-70	5.1	0	0	113.4	M571 K575	M571-Q573 VanDerWaalsContact C-OE1 3.25Å; M571-Q573 PolarHBondContact O-N 2.88Å; M571-Q573 VanDerWaalsContact O-N 3.12Å; Q573-K575 PolarHBondContact O-N 2.78Å
574	K	91.8	Very high	92.4	Very high	101 Å²	101	63.9 Å²	63.9	44%	0.439	36%	0.357	S	S	.	.			trans	-82.3	104	-179.8	176.7	167.4	171.8	162.2	0	109.9	G567 S568 M571 N576	G567-K574 WeakPolarHBondContact CA-O 3.47Å; S568-K574 PolarHBondContact N-O 3.23Å; M571-K574 HydrophobicContact CB-CB 3.96Å; M571-K574 HydrophobicContact CE-CD 4.07Å; M571-K574 WeakPolarHBondContact O-CB 3.3Å; M571-K574 PolarHBondContact O-N 2.81Å; K574-N576 WeakPolarHBondContact CE-OD1 3.44Å
575	K	92.1	Very high	92.6	Very high	62 Å²	62	66 Å²	66	27%	0.27	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	125.6	167.8	-61.1	-168.6	-175.9	-151.3	0	109.7	P560 D562 Q573	P560-K575 HydrophobicContact CG-CB 4.09Å; P560-K575 HydrophobicContact CG-CD 4.11Å; P560-K575 VanDerWaalsContact O-CD 3.27Å; P560-K575 WeakPolarHBondContact O-CD 3.27Å; P560-K575 PolarHBondContact O-NZ 3.04Å; D562-K575 WeakPolarHBondContact OD1-CE 3.42Å; D562-K575 IonicContact OD1-NZ 3.55Å; D562-K575 PolarHBondContact OD1-NZ 3.3Å; Q573-K575 PolarHBondContact O-N 2.78Å
576	N	95.4	Very high	92.8	Very high	36 Å²	36	69.1 Å²	69.1	19%	0.193	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	126.9	176.2	-43.9	-54.7	0	0	0	109.5	S565 T566 K574 D578	S565-N576 WeakPolarHBondContact CA-O 3.47Å; S565-N576 WeakPolarHBondContact CB-O 3Å; T566-N576 PolarHBondContact N-O 3.05Å; T566-N576 PolarHBondContact O-N 3.18Å; T566-N576 PolarHBondContact O-ND2 3.4Å; T566-N576 VanDerWaalsContact O-ND2 3.11Å; T566-N576 PolarHBondContact OG1-ND2 3.33Å; K574-N576 WeakPolarHBondContact CE-OD1 3.44Å; N576-D578 WeakPolarHBondContact CB-OD1 3.45Å; N576-D578 PolarHBondContact O-N 3.27Å
577	P	95.8	Very high	93.2	Very high	11 Å²	11	66.8 Å²	66.8	7%	0.071	38%	0.378	C	S	.	.			trans	-76.6	44.6	175.4	33.9	-36.9	0	0	0	112.4	V548 A551 P579 M580 E581 F636	V548-P577 HydrophobicContact CB-CG 4.26Å; V548-P577 HydrophobicContact CG1-CG 4.26Å; V548-P577 HydrophobicContact CG2-CB 4.32Å; V548-P577 HydrophobicContact CG2-CG 3.9Å; A551-P577 HydrophobicContact CB-CB 4.43Å; A551-P577 HydrophobicContact CB-CG 4.2Å; P577-P579 VanDerWaalsContact C-N 3.29Å; P577-P579 VanDerWaalsContact O-N 3.12Å; P577-M580 PolarHBondContact O-N 2.97Å; P577-E581 PolarHBondContact O-N 3.41Å; P577-E581 VanDerWaalsContact O-N 3.11Å; P577-F636 HydrophobicContact CB-CE2 4.16Å; P577-F636 HydrophobicContact CB-CZ 4.03Å
578	D	95.8	Very high	93.9	Very high	52 Å²	52	67 Å²	67	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-47.3	-40.1	-176	-66.7	-3.6	0	0	0	114.1	T566 N576 M580 E581 L582	T566-D578 WeakPolarHBondContact CB-OD2 2.75Å; T566-D578 HydrophobicContact CG2-CB 4.34Å; T566-D578 WeakPolarHBondContact CG2-OD2 3.38Å; T566-D578 PolarHBondContact OG1-OD2 2.81Å; N576-D578 WeakPolarHBondContact CB-OD1 3.45Å; N576-D578 PolarHBondContact O-N 3.27Å; D578-M580 VanDerWaalsContact C-N 3.29Å; D578-M580 PolarHBondContact O-N 3.07Å; D578-E581 PolarHBondContact O-N 3.32Å; D578-L582 WeakPolarHBondContact O-CB 3.44Å; D578-L582 WeakPolarHBondContact O-CG 3.48Å; D578-L582 PolarHBondContact O-N 3.41Å
579	P	96.3	Very high	94.4	Very high	31 Å²	31	72 Å²	72	20%	0.201	39%	0.388	C	S	.	.	H	α-helix	trans	-62.1	-36.5	178.1	-21.8	34.6	0	0	0	112.6	V564 P577 L582 V583 V632	V564-P579 WeakPolarHBondContact O-CD 3.32Å; V564-P579 WeakPolarHBondContact O-CG 3.45Å; P577-P579 VanDerWaalsContact C-N 3.29Å; P577-P579 VanDerWaalsContact O-N 3.12Å; P579-L582 PolarHBondContact O-N 3.5Å; P579-V583 WeakPolarHBondContact O-CG2 3.23Å; P579-V583 PolarHBondContact O-N 3.21Å; P579-V632 HydrophobicContact CB-CG1 3.41Å; P579-V632 VanDerWaalsContact CB-CG1 3.41Å
580	M	98.1	Very high	94.9	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-78.2	-30.9	177.6	-60.6	-51	-59.7	0	0	112.4	I543 W547 V548 P577 D578 L582 V583 R584 V632 F636	I543-M580 HydrophobicContact CG2-CE 4.1Å; W547-M580 HydrophobicContact CD2-CE 4.47Å; W547-M580 HydrophobicContact CE3-CE 3.53Å; W547-M580 HydrophobicContact CE3-CG 4.11Å; W547-M580 HydrophobicContact CE3-SD 3.77Å; W547-M580 HydrophobicContact CZ3-CE 3.95Å; W547-M580 HydrophobicContact CZ3-SD 4.09Å; V548-M580 HydrophobicContact CG2-CB 4Å; P577-M580 PolarHBondContact O-N 2.97Å; D578-M580 VanDerWaalsContact C-N 3.29Å; D578-M580 PolarHBondContact O-N 3.07Å; M580-L582 VanDerWaalsContact C-N 3.31Å; M580-V583 HydrophobicContact CE-CB 4.47Å; M580-V583 HydrophobicContact CE-CG1 4.43Å; M580-V583 PolarHBondContact O-N 3.26Å; M580-V583 HydrophobicContact SD-CG2 4.43Å; M580-R584 PolarHBondContact O-N 3.01Å; M580-V632 HydrophobicContact SD-CG1 4.44Å; M580-F636 HydrophobicContact CG-CD1 3.89Å; M580-F636 HydrophobicContact CG-CD2 3.58Å; M580-F636 HydrophobicContact CG-CE1 3.82Å; M580-F636 HydrophobicContact CG-CE2 3.55Å; M580-F636 HydrophobicContact CG-CG 3.76Å; M580-F636 HydrophobicContact CG-CZ 3.66Å; M580-F636 HydrophobicContact SD-CB 3.92Å; M580-F636 HydrophobicContact SD-CD1 4.09Å; M580-F636 HydrophobicContact SD-CD2 4.04Å; M580-F636 HydrophobicContact SD-CG 3.77Å
581	E	98.2	Very high	95.4	Very high	90 Å²	90	62.4 Å²	62.4	42%	0.421	32%	0.324	S	S	.	.	H	α-helix	trans	-63	-39.8	167.3	-61.7	-156.2	164.5	0	0	111.5	V548 P577 D578 R584 G585	V548-E581 HydrophobicContact CG1-CG 4.41Å; V548-E581 HydrophobicContact CG2-CG 3.79Å; P577-E581 PolarHBondContact O-N 3.41Å; P577-E581 VanDerWaalsContact O-N 3.11Å; D578-E581 PolarHBondContact O-N 3.32Å; E581-R584 PolarHBondContact O-N 3.31Å; E581-R584 IonicContact OE1-NH2 3.44Å; E581-G585 PolarHBondContact O-N 2.9Å
582	L	98	Very high	95.8	Very high	109 Å²	109	60 Å²	60	57%	0.571	32%	0.32	S	S	*	.	H	α-helix	trans	-69	-35.9	174.9	-71.8	172.5	0	0	0	112.7	D578 P579 M580 G585 K586	D578-L582 WeakPolarHBondContact O-CB 3.44Å; D578-L582 WeakPolarHBondContact O-CG 3.48Å; D578-L582 PolarHBondContact O-N 3.41Å; P579-L582 PolarHBondContact O-N 3.5Å; M580-L582 VanDerWaalsContact C-N 3.31Å; L582-G585 PolarHBondContact O-N 3.26Å; L582-K586 VanDerWaalsContact O-CB 3.28Å; L582-K586 WeakPolarHBondContact O-CB 3.48Å; L582-K586 WeakPolarHBondContact O-CG 3.16Å; L582-K586 PolarHBondContact O-N 3.22Å
583	V	98.1	Very high	96.5	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-50.9	170.3	166.4	0	0	0	0	110.4	L540 P579 M580 G585 K586 S587 M629 V632	L540-V583 HydrophobicContact CB-CG1 3.95Å; L540-V583 WeakPolarHBondContact O-CG1 3.44Å; P579-V583 WeakPolarHBondContact O-CG2 3.23Å; P579-V583 PolarHBondContact O-N 3.21Å; M580-V583 HydrophobicContact CE-CB 4.47Å; M580-V583 HydrophobicContact CE-CG1 4.43Å; M580-V583 PolarHBondContact O-N 3.26Å; M580-V583 HydrophobicContact SD-CG2 4.43Å; V583-G585 VanDerWaalsContact C-N 3.33Å; V583-G585 PolarHBondContact O-N 2.81Å; V583-K586 PolarHBondContact O-N 3.17Å; V583-S587 PolarHBondContact O-N 3.48Å; V583-M629 HydrophobicContact CG1-CE 4Å; V583-M629 HydrophobicContact CG1-CG 4.45Å; V583-M629 HydrophobicContact CG2-CB 4.34Å; V583-M629 HydrophobicContact CG2-CG 4.3Å; V583-M629 WeakPolarHBondContact O-CE 3.46Å; V583-V632 HydrophobicContact CG2-CB 4.14Å; V583-V632 HydrophobicContact CG2-CG1 3.64Å
584	R	97.5	Very high	97.1	Very high	67 Å²	67	49.7 Å²	49.7	25%	0.253	26%	0.263	S	S	.	.	H	α-helix	trans	-57.8	-45.1	176.2	178.3	173.8	57.7	-176.4	-6.2	111.4	E545 M580 E581 S587	E545-R584 IonicContact OE1-NH1 3.67Å; E545-R584 PolarHBondContact OE1-NH1 3.22Å; E545-R584 WeakPolarHBondContact OE2-CD 3.36Å; E545-R584 IonicContact OE2-CZ 2.67Å; E545-R584 IonicContact OE2-NE 2.66Å; E545-R584 IonicContact OE2-NH1 3.7Å; E545-R584 PolarHBondContact OE2-NH1 2.97Å; M580-R584 PolarHBondContact O-N 3.01Å; E581-R584 PolarHBondContact O-N 3.31Å; E581-R584 IonicContact OE1-NH2 3.44Å; R584-S587 PolarHBondContact O-N 2.63Å; R584-S587 PolarHBondContact O-OG 2.9Å
585	G	97.8	Very high	97.4	Very high	49 Å²	49	50.6 Å²	50.6	51%	0.505	27%	0.271	S	S	.	.	H	α-helix	trans	-68.3	-37.3	179.5	0	0	0	0	0	114.9	E581 L582 V583 S587 A588	E581-G585 PolarHBondContact O-N 2.9Å; L582-G585 PolarHBondContact O-N 3.26Å; V583-G585 VanDerWaalsContact C-N 3.33Å; V583-G585 PolarHBondContact O-N 2.81Å; G585-S587 PolarHBondContact O-N 3.14Å; G585-A588 PolarHBondContact O-N 3.08Å
586	K	97.9	Very high	97.7	Very high	77 Å²	77	51.2 Å²	51.2	34%	0.335	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-25.9	178.3	-80.8	167.9	176.9	-77.7	0	113	L582 V583 A588 R589 V590 M629	L582-K586 VanDerWaalsContact O-CB 3.28Å; L582-K586 WeakPolarHBondContact O-CB 3.48Å; L582-K586 WeakPolarHBondContact O-CG 3.16Å; L582-K586 PolarHBondContact O-N 3.22Å; V583-K586 PolarHBondContact O-N 3.17Å; K586-A588 PolarHBondContact O-N 3.46Å; K586-R589 VanDerWaalsContact O-CB 3.27Å; K586-R589 WeakPolarHBondContact O-CB 3.49Å; K586-R589 PolarHBondContact O-N 2.86Å; K586-V590 PolarHBondContact O-N 3.17Å; K586-M629 HydrophobicContact CB-CG 3.95Å; K586-M629 HydrophobicContact CB-SD 3.49Å; K586-M629 WeakPolarHBondContact CB-SD 3.33Å; K586-M629 HydrophobicContact CD-CG 3.75Å; K586-M629 HydrophobicContact CD-SD 4.37Å
587	S	98.1	Very high	97.8	Very high	11 Å²	11	49.5 Å²	49.5	8%	0.077	27%	0.27	C	S	.	.	H	α-helix	trans	-56.1	-39	178	71.8	0	0	0	0	112.9	V583 R584 G585 R589 V590 F591	V583-S587 PolarHBondContact O-N 3.48Å; R584-S587 PolarHBondContact O-N 2.63Å; R584-S587 PolarHBondContact O-OG 2.9Å; G585-S587 PolarHBondContact O-N 3.14Å; S587-R589 PolarHBondContact O-N 3.24Å; S587-V590 PolarHBondContact O-N 3.4Å; S587-F591 WeakPolarHBondContact O-CD1 3.28Å; S587-F591 WeakPolarHBondContact O-CD2 3.2Å; S587-F591 WeakPolarHBondContact O-CE1 3.42Å; S587-F591 WeakPolarHBondContact O-CG 3.28Å; S587-F591 PolarHBondContact O-N 3.46Å
588	A	98.2	Very high	97.9	Very high	66 Å²	66	52.7 Å²	52.7	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-24.3	176.5	0	0	0	0	0	114.2	G585 K586 G592	G585-A588 PolarHBondContact O-N 3.08Å; K586-A588 PolarHBondContact O-N 3.46Å; A588-G592 PolarHBondContact O-N 3.25Å
589	R	95.9	Very high	98.1	Very high	137 Å²	137	54.9 Å²	54.9	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-72.5	-54.2	174.8	-164.6	167.6	-175.7	-178.5	-12.2	110	K586 S587 F591 G592 D593 D621	K586-R589 VanDerWaalsContact O-CB 3.27Å; K586-R589 WeakPolarHBondContact O-CB 3.49Å; K586-R589 PolarHBondContact O-N 2.86Å; S587-R589 PolarHBondContact O-N 3.24Å; R589-F591 PolarHBondContact O-N 3.45Å; R589-G592 CarbonylContact O-C 3.53Å; R589-G592 VanDerWaalsContact O-CA 3.31Å; R589-G592 WeakPolarHBondContact O-CA 3.25Å; R589-G592 PolarHBondContact O-N 3.03Å; R589-D593 PolarHBondContact O-N 3.47Å; R589-D621 VanDerWaalsContact CZ-CG 3.41Å; R589-D621 IonicContact CZ-OD1 2.78Å; R589-D621 IonicContact CZ-OD2 2.83Å; R589-D621 VanDerWaalsContact NE-CG 3.28Å; R589-D621 IonicContact NE-OD1 2.65Å; R589-D621 PolarHBondContact NE-OD1 2.94Å; R589-D621 IonicContact NE-OD2 3.59Å; R589-D621 PolarHBondContact NE-OD2 2.65Å; R589-D621 IonicContact NH1-OD1 3.82Å; R589-D621 IonicContact NH2-OD1 3.89Å; R589-D621 PolarHBondContact NH2-OD1 3.38Å; R589-D621 IonicContact NH2-OD2 3.93Å; R589-D621 PolarHBondContact NH2-OD2 2.88Å
590	V	98.6	Very high	98.1	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-53	-39.6	176.4	-175.6	0	0	0	0	112.3	N533 S534 A537 K586 S587 D593 L594 A625 V626	N533-V590 HydrophobicContact CB-CG1 3.91Å; S534-V590 PolarHBondContact OG-O 3.5Å; A537-V590 HydrophobicContact CB-CB 4Å; A537-V590 HydrophobicContact CB-CG1 4Å; A537-V590 HydrophobicContact CB-CG2 4.1Å; K586-V590 PolarHBondContact O-N 3.17Å; S587-V590 PolarHBondContact O-N 3.4Å; V590-D593 VanDerWaalsContact CA-OD2 3.31Å; V590-D593 WeakPolarHBondContact CA-OD2 3.39Å; V590-D593 PolarHBondContact N-OD2 3.43Å; V590-D593 PolarHBondContact O-N 2.94Å; V590-L594 PolarHBondContact O-N 3.44Å; V590-A625 HydrophobicContact CG2-CB 3.78Å; V590-V626 HydrophobicContact CG1-CG2 4.31Å; V590-V626 HydrophobicContact CG2-CG2 4.13Å
591	F	98.6	Very high	98.1	Very high	71 Å²	71	56.7 Å²	56.7	31%	0.311	31%	0.312	S	S	.	.	H	α-helix	trans	-70.2	-36.3	175.9	-50.5	-20.5	0	0	0	112.6	S534 A537 V538 S587 R589 D593 M595	S534-F591 WeakPolarHBondContact O-CE1 3.5Å; A537-F591 HydrophobicContact CB-CE1 4.04Å; V538-F591 HydrophobicContact CG2-CE1 3.71Å; V538-F591 HydrophobicContact CG2-CZ 3.52Å; S587-F591 WeakPolarHBondContact O-CD1 3.28Å; S587-F591 WeakPolarHBondContact O-CD2 3.2Å; S587-F591 WeakPolarHBondContact O-CE1 3.42Å; S587-F591 WeakPolarHBondContact O-CG 3.28Å; S587-F591 PolarHBondContact O-N 3.46Å; R589-F591 PolarHBondContact O-N 3.45Å; F591-D593 VanDerWaalsContact C-N 3.34Å; F591-M595 WeakPolarHBondContact O-CB 3.38Å; F591-M595 VanDerWaalsContact O-CG 3.31Å; F591-M595 WeakPolarHBondContact O-CG 3.45Å; F591-M595 PolarHBondContact O-N 3.01Å; F591-M595 VanDerWaalsContact O-N 3.08Å
592	G	98.7	Very high	98.1	Very high	31 Å²	31	59.9 Å²	59.9	32%	0.32	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-38.7	173.8	0	0	0	0	0	112	A588 R589 M595 T596	A588-G592 PolarHBondContact O-N 3.25Å; R589-G592 CarbonylContact O-C 3.53Å; R589-G592 VanDerWaalsContact O-CA 3.31Å; R589-G592 WeakPolarHBondContact O-CA 3.25Å; R589-G592 PolarHBondContact O-N 3.03Å; G592-M595 PolarHBondContact O-N 3.03Å; G592-T596 WeakPolarHBondContact O-CB 3.46Å; G592-T596 PolarHBondContact O-N 2.89Å; G592-T596 PolarHBondContact O-OG1 2.77Å
593	D	98.6	Very high	98.1	Very high	15 Å²	15	58.2 Å²	58.2	8%	0.08	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-50.5	177.5	-56.3	-34.3	0	0	0	111	L530 R589 V590 F591 M595 T596 V597 P618 S622	L530-D593 HydrophobicContact CD2-CB 4Å; R589-D593 PolarHBondContact O-N 3.47Å; V590-D593 VanDerWaalsContact CA-OD2 3.31Å; V590-D593 WeakPolarHBondContact CA-OD2 3.39Å; V590-D593 PolarHBondContact N-OD2 3.43Å; V590-D593 PolarHBondContact O-N 2.94Å; F591-D593 VanDerWaalsContact C-N 3.34Å; D593-M595 PolarHBondContact O-N 2.98Å; D593-T596 WeakPolarHBondContact O-CB 3.49Å; D593-T596 PolarHBondContact O-N 3.27Å; D593-V597 PolarHBondContact O-N 3.38Å; D593-V597 VanDerWaalsContact O-N 3.14Å; D593-P618 HydrophobicContact CB-CB 3.8Å; D593-P618 WeakPolarHBondContact CB-O 3.46Å; D593-S622 WeakPolarHBondContact OD2-CA 3.29Å; D593-S622 PolarHBondContact OD2-N 3.14Å
594	L	98.7	Very high	98.1	Very high	25 Å²	25	60.5 Å²	60.5	13%	0.131	35%	0.345	C	S	.	.	H	α-helix	trans	-56.7	-48.7	173.9	174.4	61.8	0	0	0	112.2	L530 A531 S534 V590 T596 V597 L598	L530-L594 HydrophobicContact CB-CB 4.07Å; L530-L594 HydrophobicContact CB-CD1 3.77Å; A531-L594 HydrophobicContact CB-CD1 4.23Å; A531-L594 HydrophobicContact CB-CD2 4.32Å; S534-L594 WeakPolarHBondContact OG-CD2 3.41Å; V590-L594 PolarHBondContact O-N 3.44Å; L594-T596 VanDerWaalsContact C-N 3.25Å; L594-T596 PolarHBondContact O-N 2.7Å; L594-V597 PolarHBondContact O-N 3.1Å; L594-L598 HydrophobicContact CD1-CD1 3.84Å; L594-L598 HydrophobicContact CD1-CG 3.98Å; L594-L598 HydrophobicContact CD2-CD1 4.48Å; L594-L598 HydrophobicContact CG-CD1 3.81Å; L594-L598 HydrophobicContact CG-CG 4.38Å; L594-L598 WeakPolarHBondContact O-CB 3.11Å; L594-L598 WeakPolarHBondContact O-CG 3.45Å; L594-L598 PolarHBondContact O-N 2.81Å
595	M	98.7	Very high	98.1	Very high	121 Å²	121	61.2 Å²	61.2	60%	0.596	36%	0.359	S	S	*	.	H	α-helix	trans	-65.2	-29.9	-179.7	-75.1	-69.4	-179.8	0	0	112.7	F591 G592 D593 L598 T599	F591-M595 WeakPolarHBondContact O-CB 3.38Å; F591-M595 VanDerWaalsContact O-CG 3.31Å; F591-M595 WeakPolarHBondContact O-CG 3.45Å; F591-M595 PolarHBondContact O-N 3.01Å; F591-M595 VanDerWaalsContact O-N 3.08Å; G592-M595 PolarHBondContact O-N 3.03Å; D593-M595 PolarHBondContact O-N 2.98Å; M595-L598 HydrophobicContact SD-CD1 4.45Å; M595-T599 VanDerWaalsContact O-CB 3.29Å; M595-T599 WeakPolarHBondContact O-CB 3.22Å; M595-T599 PolarHBondContact O-N 3.36Å; M595-T599 VanDerWaalsContact O-N 3.1Å; M595-T599 PolarHBondContact O-OG1 3.41Å
596	T	98.4	Very high	98.1	Very high	74 Å²	74	65.2 Å²	65.2	45%	0.454	36%	0.364	S	S	.	.	H	α-helix	trans	-66.6	-54	175.8	-60.8	0	0	0	0	110.1	G592 D593 L594 T599 L600 P618	G592-T596 WeakPolarHBondContact O-CB 3.46Å; G592-T596 PolarHBondContact O-N 2.89Å; G592-T596 PolarHBondContact O-OG1 2.77Å; D593-T596 WeakPolarHBondContact O-CB 3.49Å; D593-T596 PolarHBondContact O-N 3.27Å; L594-T596 VanDerWaalsContact C-N 3.25Å; L594-T596 PolarHBondContact O-N 2.7Å; T596-T599 PolarHBondContact O-N 3.34Å; T596-T599 VanDerWaalsContact O-N 3.17Å; T596-L600 WeakPolarHBondContact O-CB 3.31Å; T596-L600 PolarHBondContact O-N 3.43Å; T596-P618 HydrophobicContact CG2-CG 3.98Å
597	V	98.2	Very high	98.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-70.4	-35.1	-178.1	-170.3	0	0	0	0	112	V526 L527 L530 D593 L594 T599 L600 C601 P618	V526-V597 HydrophobicContact CG1-CG1 4.17Å; L527-V597 HydrophobicContact CD2-CB 3.94Å; L527-V597 HydrophobicContact CD2-CG1 3.66Å; L527-V597 HydrophobicContact CG-CG1 4.48Å; L530-V597 HydrophobicContact CD1-CB 3.8Å; L530-V597 HydrophobicContact CD1-CG1 4.47Å; L530-V597 HydrophobicContact CD1-CG2 3.54Å; D593-V597 PolarHBondContact O-N 3.38Å; D593-V597 VanDerWaalsContact O-N 3.14Å; L594-V597 PolarHBondContact O-N 3.1Å; V597-T599 VanDerWaalsContact C-N 3.29Å; V597-T599 PolarHBondContact O-N 3.3Å; V597-L600 WeakPolarHBondContact O-CB 3.37Å; V597-L600 PolarHBondContact O-N 3.47Å; V597-C601 PolarHBondContact O-N 3.35Å; V597-C601 PolarHBondContact O-SG 3.44Å; V597-P618 HydrophobicContact CG2-CB 3.82Å; V597-P618 HydrophobicContact CG2-CG 3.97Å
598	L	98.5	Very high	98	Very high	78 Å²	78	63.9 Å²	63.9	41%	0.408	36%	0.36	S	S	.	.	H	α-helix	trans	-58.3	-40.8	170.2	-78.9	171.9	0	0	0	112.2	L527 L594 M595 K602	L527-L598 HydrophobicContact CD1-CD2 4.29Å; L527-L598 HydrophobicContact CD2-CB 4.49Å; L527-L598 HydrophobicContact CD2-CD2 3.86Å; L527-L598 HydrophobicContact CD2-CG 3.98Å; L594-L598 HydrophobicContact CD1-CD1 3.84Å; L594-L598 HydrophobicContact CD1-CG 3.98Å; L594-L598 HydrophobicContact CD2-CD1 4.48Å; L594-L598 HydrophobicContact CG-CD1 3.81Å; L594-L598 HydrophobicContact CG-CG 4.38Å; L594-L598 WeakPolarHBondContact O-CB 3.11Å; L594-L598 WeakPolarHBondContact O-CG 3.45Å; L594-L598 PolarHBondContact O-N 2.81Å; M595-L598 HydrophobicContact SD-CD1 4.45Å; L598-K602 PolarHBondContact O-N 3.44Å
599	T	98.4	Very high	97.9	Very high	98 Å²	98	62.5 Å²	62.5	60%	0.601	34%	0.343	S	S	*	.	H	α-helix	trans	-73.7	-36	178.8	-57.1	0	0	0	0	111.6	M595 T596 V597 K602	M595-T599 VanDerWaalsContact O-CB 3.29Å; M595-T599 WeakPolarHBondContact O-CB 3.22Å; M595-T599 PolarHBondContact O-N 3.36Å; M595-T599 VanDerWaalsContact O-N 3.1Å; M595-T599 PolarHBondContact O-OG1 3.41Å; T596-T599 PolarHBondContact O-N 3.34Å; T596-T599 VanDerWaalsContact O-N 3.17Å; V597-T599 VanDerWaalsContact C-N 3.29Å; V597-T599 PolarHBondContact O-N 3.3Å; T599-K602 WeakPolarHBondContact O-CB 3.39Å
600	L	97.4	Very high	97.8	Very high	35 Å²	35	59.8 Å²	59.8	18%	0.183	33%	0.333	C	S	.	.	H	α-helix	trans	-62.2	-52.5	177	-176.3	70.6	0	0	0	111.8	T596 V597 K602 L604 D611 E614	T596-L600 WeakPolarHBondContact O-CB 3.31Å; T596-L600 PolarHBondContact O-N 3.43Å; V597-L600 WeakPolarHBondContact O-CB 3.37Å; V597-L600 PolarHBondContact O-N 3.47Å; L600-K602 PolarHBondContact O-N 2.94Å; L600-L604 WeakPolarHBondContact O-CG 3.18Å; L600-D611 HydrophobicContact CD1-CB 4.27Å; L600-D611 WeakPolarHBondContact CD1-O 3.27Å; L600-E614 HydrophobicContact CD1-CB 3.89Å; L600-E614 HydrophobicContact CD1-CG 4.19Å; L600-E614 HydrophobicContact CD2-CB 3.76Å; L600-E614 HydrophobicContact CG-CB 4.47Å
601	C	97.7	Very high	97.6	Very high	35 Å²	35	63.6 Å²	63.6	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-70.3	-19.3	-177.6	-64.1	0	0	0	0	113.3	V597 G603 L604	V597-C601 PolarHBondContact O-N 3.35Å; V597-C601 PolarHBondContact O-SG 3.44Å; C601-G603 PolarHBondContact O-N 3.5Å; C601-L604 PolarHBondContact O-N 3.07Å
602	K	98.2	Very high	97.4	Very high	157 Å²	157	60.6 Å²	60.6	68%	0.683	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	99.8	-174.5	-175.7	-132.9	106	-88.4	0	112.2	L598 T599 L600	L598-K602 PolarHBondContact O-N 3.44Å; T599-K602 WeakPolarHBondContact O-CB 3.39Å; L600-K602 PolarHBondContact O-N 2.94Å
603	G	97.9	Very high	97.1	Very high	73 Å²	73	60.5 Å²	60.5	75%	0.753	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	26.1	169.9	0	0	0	0	0	114.7	C601	C601-G603 PolarHBondContact O-N 3.5Å
604	L	97.8	Very high	96.8	Very high	50 Å²	50	64.9 Å²	64.9	26%	0.262	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-63.2	141.7	160.9	-62.5	177.2	0	0	0	109.6	L600 C601 D611 L612	L600-L604 WeakPolarHBondContact O-CG 3.18Å; C601-L604 PolarHBondContact O-N 3.07Å; L604-D611 HydrophobicContact CD1-CB 4.16Å; L604-D611 HydrophobicContact CD2-CB 3.83Å; L604-L612 HydrophobicContact CD1-CD2 3.53Å; L604-L612 HydrophobicContact CD1-CG 4.13Å
605	P	97.9	Very high	96.7	Very high	83 Å²	83	63.8 Å²	63.8	54%	0.539	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-74.6	155.3	172	33.1	-34.3	0	0	0	110.4	N609	P605-N609 PolarHBondContact O-ND2 2.75Å
606	Q	97.5	Very high	96.5	Very high	132 Å²	132	58.6 Å²	58.6	62%	0.617	32%	0.32	S	S	*	.	S	Bend	trans	-71.2	143.5	169.4	-76.6	-71.8	-19.3	0	0	110.4	I517 S521	I517-Q606 HydrophobicContact CG2-CB 4.24Å; I517-Q606 HydrophobicContact CG2-CG 4.42Å; S521-Q606 VanDerWaalsContact CB-OE1 3.24Å; S521-Q606 PolarHBondContact OG-NE2 3.43Å; S521-Q606 PolarHBondContact OG-OE1 3.09Å
607	A	97.3	Very high	96.2	Very high	18 Å²	18	60.9 Å²	60.9	15%	0.149	33%	0.326	C	S	.	.	S	Bend	cis	-101.9	-111.7	7.4	0	0	0	0	0	113.2	L491 I517 V520 N609	L491-A607 HydrophobicContact CB-CB 3.91Å; I517-A607 HydrophobicContact CG2-CB 3.97Å; V520-A607 HydrophobicContact CG2-CB 3.99Å; A607-N609 PolarHBondContact O-ND2 2.87Å; A607-N609 VanDerWaalsContact O-ND2 3.13Å
608	Y	97.4	Very high	96.1	Very high	43 Å²	43	61.5 Å²	61.5	17%	0.169	33%	0.33	C	S	.	.			trans	-65.4	135.3	170.4	172.9	-89.6	0	0	0	110.9	W295 L612	W295-Y608 HydrophobicContact CH2-CD1 4.13Å; W295-Y608 AromaticContact CH2-CE1 3.54Å; W295-Y608 HydrophobicContact CH2-CE1 3.54Å; W295-Y608 HydrophobicContact CZ2-CE1 4.45Å; W295-Y608 HydrophobicContact CZ3-CE1 4.06Å; Y608-L612 HydrophobicContact CD2-CB 4.38Å; Y608-L612 HydrophobicContact CD2-CD1 4.19Å; Y608-L612 HydrophobicContact CE2-CB 4.12Å
609	N	96.2	Very high	96.1	Very high	37 Å²	37	57.8 Å²	57.8	20%	0.198	31%	0.31	C	S	.	.			trans	-125.7	154.5	168.3	-55.8	-95.2	0	0	0	108.9	P605 A607 D611 L612	P605-N609 PolarHBondContact O-ND2 2.75Å; A607-N609 PolarHBondContact O-ND2 2.87Å; A607-N609 VanDerWaalsContact O-ND2 3.13Å; N609-D611 HydrophobicContact CB-CB 4.48Å; N609-D611 VanDerWaalsContact CB-OD2 3.29Å; N609-D611 WeakPolarHBondContact CB-OD2 3.14Å; N609-D611 PolarHBondContact O-N 2.8Å; N609-L612 WeakPolarHBondContact O-CB 3.38Å; N609-L612 PolarHBondContact O-N 3.24Å
610	R	92.5	Very high	96	Very high	80 Å²	80	54.1 Å²	54.1	30%	0.302	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-65.2	-21.5	-177.2	-165.1	67.5	-170.7	-130.7	-5.7	112.8	T310 E373 L612 Q613	T310-R610 PolarHBondContact O-NH2 3.5Å; E373-R610 IonicContact OE1-CZ 2.83Å; E373-R610 IonicContact OE1-NH1 3.39Å; E373-R610 PolarHBondContact OE1-NH1 3.28Å; E373-R610 IonicContact OE1-NH2 3.08Å; E373-R610 PolarHBondContact OE1-NH2 3.01Å; R610-L612 PolarHBondContact O-N 3.22Å; R610-Q613 VanDerWaalsContact O-CB 3.23Å; R610-Q613 WeakPolarHBondContact O-CB 3.28Å; R610-Q613 PolarHBondContact O-N 3.43Å
611	D	94.7	Very high	96	Very high	80 Å²	80	54.2 Å²	54.2	43%	0.428	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-50.2	-34.7	168.7	-47.1	-111.9	0	0	0	111.9	L600 L604 N609 Q613 E614	L600-D611 HydrophobicContact CD1-CB 4.27Å; L600-D611 WeakPolarHBondContact CD1-O 3.27Å; L604-D611 HydrophobicContact CD1-CB 4.16Å; L604-D611 HydrophobicContact CD2-CB 3.83Å; N609-D611 HydrophobicContact CB-CB 4.48Å; N609-D611 VanDerWaalsContact CB-OD2 3.29Å; N609-D611 WeakPolarHBondContact CB-OD2 3.14Å; N609-D611 PolarHBondContact O-N 2.8Å; D611-Q613 PolarHBondContact O-N 3.06Å; D611-E614 PolarHBondContact O-N 3.39Å; D611-E614 VanDerWaalsContact O-N 3.11Å
612	L	95.3	Very high	96.1	Very high	7 Å²	7	52.5 Å²	52.5	4%	0.037	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-71.3	16.9	175.2	-55.5	179.9	0	0	0	113.8	R523 L604 Y608 N609 R610	R523-L612 HydrophobicContact CG-CD2 4.04Å; R523-L612 PolarHBondContact NH2-O 3.42Å; L604-L612 HydrophobicContact CD1-CD2 3.53Å; L604-L612 HydrophobicContact CD1-CG 4.13Å; Y608-L612 HydrophobicContact CD2-CB 4.38Å; Y608-L612 HydrophobicContact CD2-CD1 4.19Å; Y608-L612 HydrophobicContact CE2-CB 4.12Å; N609-L612 WeakPolarHBondContact O-CB 3.38Å; N609-L612 PolarHBondContact O-N 3.24Å; R610-L612 PolarHBondContact O-N 3.22Å
613	Q	91.8	Very high	96.1	Very high	30 Å²	30	45.4 Å²	45.4	14%	0.14	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-86.6	-26.5	164	-176.6	176.2	-17.2	0	0	112	T310 R610 D611 D615 K616	T310-Q613 PolarHBondContact O-NE2 2.88Å; T310-Q613 PolarHBondContact O-OE1 3.2Å; R610-Q613 VanDerWaalsContact O-CB 3.23Å; R610-Q613 WeakPolarHBondContact O-CB 3.28Å; R610-Q613 PolarHBondContact O-N 3.43Å; D611-Q613 PolarHBondContact O-N 3.06Å; Q613-D615 PolarHBondContact O-N 2.97Å; Q613-D615 VanDerWaalsContact O-OD1 3.12Å; Q613-K616 PolarHBondContact O-NZ 3.35Å
614	E	93.1	Very high	96.1	Very high	107 Å²	107	48.8 Å²	48.8	50%	0.5	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	9.6	-177.7	-52.5	-68.8	113.1	0	0	113.1	L600 D611 P618	L600-E614 HydrophobicContact CD1-CB 3.89Å; L600-E614 HydrophobicContact CD1-CG 4.19Å; L600-E614 HydrophobicContact CD2-CB 3.76Å; L600-E614 HydrophobicContact CG-CB 4.47Å; D611-E614 PolarHBondContact O-N 3.39Å; D611-E614 VanDerWaalsContact O-N 3.11Å; E614-P618 WeakPolarHBondContact O-CD 3.31Å
615	D	95	Very high	96.1	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-32	-178.9	59.6	-13	0	0	0	113.7	R523 Q613 L619	R523-D615 IonicContact CZ-OD2 3.46Å; R523-D615 IonicContact NE-OD2 3.47Å; R523-D615 PolarHBondContact NE-OD2 3.43Å; R523-D615 IonicContact NH2-OD2 2.71Å; R523-D615 PolarHBondContact NH2-OD2 3.02Å; Q613-D615 PolarHBondContact O-N 2.97Å; Q613-D615 VanDerWaalsContact O-OD1 3.12Å; D615-L619 VanDerWaalsContact O-CB 3.32Å; D615-L619 WeakPolarHBondContact O-CB 3.39Å
616	K	94.7	Very high	96.2	Very high	12 Å²	12	42.6 Å²	42.6	5%	0.052	20%	0.202	C	C	.	.	H	α-helix	trans	-77.5	-50.4	-169.2	-80.4	168.8	-55.2	-55.4	0	113.9	E317 L321 I404 L408 Q613 L619 F620	E317-K616 VanDerWaalsContact CD-CE 3.46Å; E317-K616 HydrophobicContact CG-CD 4.19Å; E317-K616 WeakPolarHBondContact OE1-CD 3.35Å; E317-K616 WeakPolarHBondContact OE1-CE 3.39Å; L321-K616 HydrophobicContact CD1-CD 3.91Å; I404-K616 HydrophobicContact CD1-CD 4.29Å; L408-K616 HydrophobicContact CD1-CG 3.94Å; Q613-K616 PolarHBondContact O-NZ 3.35Å; K616-L619 PolarHBondContact O-N 3.21Å; K616-L619 VanDerWaalsContact O-N 3.11Å; K616-F620 HydrophobicContact CB-CD2 4.2Å; K616-F620 HydrophobicContact CB-CE1 4.33Å; K616-F620 HydrophobicContact CB-CE2 3.7Å; K616-F620 HydrophobicContact CB-CZ 3.77Å; K616-F620 HydrophobicContact CD-CE2 4.35Å; K616-F620 HydrophobicContact CD-CZ 4.05Å; K616-F620 HydrophobicContact CG-CE1 4.23Å; K616-F620 HydrophobicContact CG-CE2 4.06Å; K616-F620 HydrophobicContact CG-CZ 3.66Å; K616-F620 WeakPolarHBondContact O-CB 3.33Å; K616-F620 WeakPolarHBondContact O-CG 3.46Å; K616-F620 PolarHBondContact O-N 2.81Å
617	E	93.4	Very high	96.2	Very high	123 Å²	123	37.7 Å²	37.7	58%	0.575	18%	0.18	S	C	*	.	H	α-helix	trans	-57.9	-47.4	-175.3	-62	-166.3	171.3	0	0	112.4	P313 L619 D621	P313-E617 VanDerWaalsContact CD-OE1 3.28Å; P313-E617 WeakPolarHBondContact CD-OE1 3.31Å; P313-E617 WeakPolarHBondContact CG-OE1 3.44Å; E617-L619 VanDerWaalsContact C-N 3.32Å; E617-L619 PolarHBondContact O-N 2.73Å; E617-D621 WeakPolarHBondContact O-CB 3.45Å; E617-D621 PolarHBondContact O-N 2.71Å
618	P	96.5	Very high	96.3	Very high	13 Å²	13	37.7 Å²	37.7	8%	0.084	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-37.4	175.6	-22.6	35.2	0	0	0	113.2	D593 T596 V597 E614 S622	D593-P618 HydrophobicContact CB-CB 3.8Å; D593-P618 WeakPolarHBondContact CB-O 3.46Å; T596-P618 HydrophobicContact CG2-CG 3.98Å; V597-P618 HydrophobicContact CG2-CB 3.82Å; V597-P618 HydrophobicContact CG2-CG 3.97Å; E614-P618 WeakPolarHBondContact O-CD 3.31Å; P618-S622 WeakPolarHBondContact O-CB 3.46Å; P618-S622 PolarHBondContact O-N 3.49Å
619	L	97.7	Very high	96.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-69.2	-48.2	-179	172.2	60.8	0	0	0	112.3	L408 W411 V526 F529 D615 K616 E617 D621 V623	L408-L619 HydrophobicContact CD1-CD2 3.78Å; L408-L619 HydrophobicContact CD2-CD2 4.17Å; L408-L619 HydrophobicContact CG-CD2 4Å; W411-L619 HydrophobicContact CE3-CD2 4.28Å; W411-L619 HydrophobicContact CE3-CG 4.36Å; W411-L619 HydrophobicContact CH2-CG 4.21Å; W411-L619 HydrophobicContact CZ3-CD1 3.87Å; W411-L619 HydrophobicContact CZ3-CD2 4.01Å; W411-L619 HydrophobicContact CZ3-CG 3.61Å; V526-L619 HydrophobicContact CG1-CB 4.25Å; V526-L619 HydrophobicContact CG1-CD1 4.32Å; V526-L619 HydrophobicContact CG1-CD2 4.05Å; V526-L619 HydrophobicContact CG1-CG 4.44Å; V526-L619 HydrophobicContact CG2-CD2 4.11Å; F529-L619 HydrophobicContact CD1-CD1 3.69Å; F529-L619 HydrophobicContact CE1-CD1 4.07Å; D615-L619 VanDerWaalsContact O-CB 3.32Å; D615-L619 WeakPolarHBondContact O-CB 3.39Å; K616-L619 PolarHBondContact O-N 3.21Å; K616-L619 VanDerWaalsContact O-N 3.11Å; E617-L619 VanDerWaalsContact C-N 3.32Å; E617-L619 PolarHBondContact O-N 2.73Å; L619-D621 VanDerWaalsContact C-N 3.34Å; L619-V623 WeakPolarHBondContact O-CG2 3.44Å; L619-V623 PolarHBondContact O-N 3.39Å; L619-V623 VanDerWaalsContact O-N 3.16Å
620	F	97.2	Very high	96.4	Very high	20 Å²	20	33.9 Å²	33.9	9%	0.088	16%	0.164	C	C	.	.	H	α-helix	trans	-63.1	-43	177.6	-59.8	-16.4	0	0	0	110.7	E320 L321 L408 W411 K616 V623 K624	E320-F620 HydrophobicContact CB-CD2 4.17Å; E320-F620 HydrophobicContact CB-CE1 4.28Å; E320-F620 HydrophobicContact CB-CE2 3.86Å; E320-F620 HydrophobicContact CB-CZ 3.92Å; E320-F620 HydrophobicContact CG-CD1 4.46Å; E320-F620 HydrophobicContact CG-CD2 3.8Å; E320-F620 HydrophobicContact CG-CE2 4.02Å; E320-F620 HydrophobicContact CG-CG 4.04Å; E320-F620 HydrophobicContact CG-CZ 4.44Å; L321-F620 HydrophobicContact CD1-CZ 4.07Å; L321-F620 HydrophobicContact CD2-CE1 4.29Å; L321-F620 HydrophobicContact CD2-CZ 4.02Å; L321-F620 HydrophobicContact CG-CZ 3.83Å; L408-F620 HydrophobicContact CD1-CE1 3.91Å; L408-F620 HydrophobicContact CD1-CZ 4.33Å; W411-F620 HydrophobicContact CD2-CD1 4.17Å; W411-F620 AromaticContact CD2-CE1 3.94Å; W411-F620 HydrophobicContact CD2-CE1 3.94Å; W411-F620 AromaticContact CE2-CD1 3.73Å; W411-F620 AromaticContact CE2-CE1 3.83Å; W411-F620 HydrophobicContact CE3-CD1 4.27Å; W411-F620 HydrophobicContact CE3-CE1 4.21Å; W411-F620 HydrophobicContact CG-CE1 4.46Å; W411-F620 AromaticContact CH2-CD1 3.6Å; W411-F620 HydrophobicContact CH2-CD1 3.6Å; W411-F620 HydrophobicContact CH2-CE1 4.32Å; W411-F620 HydrophobicContact CZ2-CB 4.45Å; W411-F620 AromaticContact CZ2-CD1 3.44Å; W411-F620 HydrophobicContact CZ2-CD1 3.44Å; W411-F620 VanDerWaalsContact CZ2-CD1 3.44Å; W411-F620 HydrophobicContact CZ2-CE1 4.04Å; W411-F620 HydrophobicContact CZ2-CG 4.25Å; W411-F620 HydrophobicContact CZ3-CD1 4.03Å; W411-F620 HydrophobicContact CZ3-CE1 4.41Å; K616-F620 HydrophobicContact CB-CD2 4.2Å; K616-F620 HydrophobicContact CB-CE1 4.33Å; K616-F620 HydrophobicContact CB-CE2 3.7Å; K616-F620 HydrophobicContact CB-CZ 3.77Å; K616-F620 HydrophobicContact CD-CE2 4.35Å; K616-F620 HydrophobicContact CD-CZ 4.05Å; K616-F620 HydrophobicContact CG-CE1 4.23Å; K616-F620 HydrophobicContact CG-CE2 4.06Å; K616-F620 HydrophobicContact CG-CZ 3.66Å; K616-F620 WeakPolarHBondContact O-CB 3.33Å; K616-F620 WeakPolarHBondContact O-CG 3.46Å; K616-F620 PolarHBondContact O-N 2.81Å; F620-V623 PolarHBondContact O-N 2.89Å; F620-K624 VanDerWaalsContact O-CB 3.24Å; F620-K624 WeakPolarHBondContact O-CB 3.35Å; F620-K624 PolarHBondContact O-N 3.26Å
621	D	97.1	Very high	96.7	Very high	37 Å²	37	33.9 Å²	33.9	20%	0.198	17%	0.167	C	C	.	.	H	α-helix	trans	-67.4	-41.9	-179.9	-162.2	24.5	0	0	0	112.6	R589 E617 L619 K624 A625	R589-D621 VanDerWaalsContact CZ-CG 3.41Å; R589-D621 IonicContact CZ-OD1 2.78Å; R589-D621 IonicContact CZ-OD2 2.83Å; R589-D621 VanDerWaalsContact NE-CG 3.28Å; R589-D621 IonicContact NE-OD1 2.65Å; R589-D621 PolarHBondContact NE-OD1 2.94Å; R589-D621 IonicContact NE-OD2 3.59Å; R589-D621 PolarHBondContact NE-OD2 2.65Å; R589-D621 IonicContact NH1-OD1 3.82Å; R589-D621 IonicContact NH2-OD1 3.89Å; R589-D621 PolarHBondContact NH2-OD1 3.38Å; R589-D621 IonicContact NH2-OD2 3.93Å; R589-D621 PolarHBondContact NH2-OD2 2.88Å; E617-D621 WeakPolarHBondContact O-CB 3.45Å; E617-D621 PolarHBondContact O-N 2.71Å; L619-D621 VanDerWaalsContact C-N 3.34Å; D621-K624 PolarHBondContact O-N 2.86Å; D621-A625 VanDerWaalsContact O-CB 3.28Å; D621-A625 WeakPolarHBondContact O-CB 3.05Å; D621-A625 PolarHBondContact O-N 3.39Å
622	S	98.5	Very high	96.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.4	-49.1	173.8	179.7	0	0	0	0	112.3	L530 N533 D593 P618 A625 V626	L530-S622 WeakPolarHBondContact CD2-OG 3.47Å; N533-S622 WeakPolarHBondContact CB-OG 3.42Å; N533-S622 PolarHBondContact ND2-OG 2.93Å; D593-S622 WeakPolarHBondContact OD2-CA 3.29Å; D593-S622 PolarHBondContact OD2-N 3.14Å; P618-S622 WeakPolarHBondContact O-CB 3.46Å; P618-S622 PolarHBondContact O-N 3.49Å; S622-A625 PolarHBondContact O-N 3.11Å; S622-V626 WeakPolarHBondContact O-CG2 3.02Å; S622-V626 PolarHBondContact O-N 2.94Å
623	V	98.5	Very high	97	Very high	8 Å²	8	31.9 Å²	31.9	5%	0.048	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-45.2	177.7	166.3	0	0	0	0	111.2	W411 A415 I419 F529 L619 F620 A625 V626 L627	W411-V623 HydrophobicContact CH2-CB 3.71Å; W411-V623 HydrophobicContact CH2-CG1 3.97Å; W411-V623 HydrophobicContact CH2-CG2 3.56Å; W411-V623 HydrophobicContact CZ2-CB 4.44Å; W411-V623 HydrophobicContact CZ2-CG1 4.34Å; W411-V623 HydrophobicContact CZ3-CG2 3.94Å; A415-V623 HydrophobicContact CB-CG1 3.99Å; A415-V623 HydrophobicContact CB-CG2 4.2Å; I419-V623 HydrophobicContact CD1-CG1 4.22Å; I419-V623 HydrophobicContact CD1-CG2 4.16Å; F529-V623 HydrophobicContact CE1-CG2 3.65Å; F529-V623 HydrophobicContact CE2-CG2 4.25Å; F529-V623 HydrophobicContact CZ-CG2 3.42Å; F529-V623 VanDerWaalsContact CZ-CG2 3.42Å; L619-V623 WeakPolarHBondContact O-CG2 3.44Å; L619-V623 PolarHBondContact O-N 3.39Å; L619-V623 VanDerWaalsContact O-N 3.16Å; F620-V623 PolarHBondContact O-N 2.89Å; V623-A625 VanDerWaalsContact C-N 3.29Å; V623-A625 PolarHBondContact O-N 3.04Å; V623-V626 PolarHBondContact O-N 3.46Å; V623-L627 HydrophobicContact CG1-CD1 3.77Å; V623-L627 HydrophobicContact CG1-CG 4.34Å; V623-L627 WeakPolarHBondContact O-CB 3.24Å; V623-L627 WeakPolarHBondContact O-CG 3.46Å; V623-L627 PolarHBondContact O-N 3.1Å
624	K	97.7	Very high	97.4	Very high	144 Å²	144	31.1 Å²	31.1	63%	0.626	16%	0.155	S	C	*	.	H	α-helix	trans	-62.1	-35.8	176.9	-172	170.3	-168.2	156.6	0	112.5	F620 D621 G628	F620-K624 VanDerWaalsContact O-CB 3.24Å; F620-K624 WeakPolarHBondContact O-CB 3.35Å; F620-K624 PolarHBondContact O-N 3.26Å; D621-K624 PolarHBondContact O-N 2.86Å; K624-G628 PolarHBondContact O-N 3.33Å
625	A	98.3	Very high	97.6	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.025	15%	0.152	C	C	.	.	H	α-helix	trans	-68.8	-49.5	173.9	0	0	0	0	0	111.7	V590 D621 S622 V623 G628 M629	V590-A625 HydrophobicContact CG2-CB 3.78Å; D621-A625 VanDerWaalsContact O-CB 3.28Å; D621-A625 WeakPolarHBondContact O-CB 3.05Å; D621-A625 PolarHBondContact O-N 3.39Å; S622-A625 PolarHBondContact O-N 3.11Å; V623-A625 VanDerWaalsContact C-N 3.29Å; V623-A625 PolarHBondContact O-N 3.04Å; A625-G628 PolarHBondContact O-N 2.81Å; A625-M629 WeakPolarHBondContact O-CB 3.24Å; A625-M629 WeakPolarHBondContact O-CG 3.14Å; A625-M629 PolarHBondContact O-N 2.71Å
626	V	98.8	Very high	97.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65	-44.3	-178.6	169.7	0	0	0	0	112.3	I419 N533 V590 S622 V623 M629 L630	I419-V626 HydrophobicContact CD1-CB 4.5Å; I419-V626 HydrophobicContact CD1-CG1 4.16Å; I419-V626 HydrophobicContact CG1-CG1 4.35Å; I419-V626 HydrophobicContact CG2-CG1 4.01Å; N533-V626 HydrophobicContact CB-CG2 3.86Å; V590-V626 HydrophobicContact CG1-CG2 4.31Å; V590-V626 HydrophobicContact CG2-CG2 4.13Å; S622-V626 WeakPolarHBondContact O-CG2 3.02Å; S622-V626 PolarHBondContact O-N 2.94Å; V623-V626 PolarHBondContact O-N 3.46Å; V626-M629 PolarHBondContact O-N 2.65Å; V626-L630 HydrophobicContact CG1-CD1 3.87Å; V626-L630 WeakPolarHBondContact O-CG 3.42Å; V626-L630 PolarHBondContact O-N 2.66Å
627	L	98.7	Very high	97.9	Very high	29 Å²	29	29.9 Å²	29.9	15%	0.152	15%	0.15	C	C	.	.	H	α-helix	trans	-58	-51.5	175.5	-73.6	171.3	0	0	0	111.2	K418 I419 R422 V623 M629 L630 E631	K418-L627 HydrophobicContact CB-CD1 4.5Å; K418-L627 HydrophobicContact CB-CD2 4.07Å; I419-L627 HydrophobicContact CB-CD2 4.36Å; I419-L627 HydrophobicContact CG1-CD2 3.59Å; I419-L627 HydrophobicContact CG1-CG 3.85Å; R422-L627 HydrophobicContact CB-CD2 4.33Å; R422-L627 HydrophobicContact CG-CD2 3.72Å; V623-L627 HydrophobicContact CG1-CD1 3.77Å; V623-L627 HydrophobicContact CG1-CG 4.34Å; V623-L627 WeakPolarHBondContact O-CB 3.24Å; V623-L627 WeakPolarHBondContact O-CG 3.46Å; V623-L627 PolarHBondContact O-N 3.1Å; L627-M629 VanDerWaalsContact C-N 3.29Å; L627-M629 PolarHBondContact O-N 3.17Å; L627-L630 PolarHBondContact O-N 2.73Å; L627-E631 VanDerWaalsContact O-CG 3.32Å; L627-E631 WeakPolarHBondContact O-CG 3.47Å; L627-E631 PolarHBondContact O-N 2.87Å
628	G	98.4	Very high	98.1	Very high	17 Å²	17	29.7 Å²	29.7	18%	0.175	15%	0.149	C	C	.	.	H	α-helix	trans	-65.4	-28.4	178.3	0	0	0	0	0	113.9	K624 A625 V632	K624-G628 PolarHBondContact O-N 3.33Å; A625-G628 PolarHBondContact O-N 2.81Å; G628-V632 WeakPolarHBondContact O-CB 3.42Å; G628-V632 WeakPolarHBondContact O-CG2 3.38Å; G628-V632 PolarHBondContact O-N 3.07Å; G628-V632 VanDerWaalsContact O-N 3.09Å
629	M	98.7	Very high	98.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.9	-43.5	172.6	-74.1	165.5	63.5	0	0	111.6	A537 L540 V583 K586 A625 V626 L627 C633	A537-M629 HydrophobicContact CB-CE 3.93Å; L540-M629 HydrophobicContact CB-CE 3.74Å; L540-M629 HydrophobicContact CD1-CB 3.98Å; L540-M629 HydrophobicContact CD1-CE 4.06Å; V583-M629 HydrophobicContact CG1-CE 4Å; V583-M629 HydrophobicContact CG1-CG 4.45Å; V583-M629 HydrophobicContact CG2-CB 4.34Å; V583-M629 HydrophobicContact CG2-CG 4.3Å; V583-M629 WeakPolarHBondContact O-CE 3.46Å; K586-M629 HydrophobicContact CB-CG 3.95Å; K586-M629 HydrophobicContact CB-SD 3.49Å; K586-M629 WeakPolarHBondContact CB-SD 3.33Å; K586-M629 HydrophobicContact CD-CG 3.75Å; K586-M629 HydrophobicContact CD-SD 4.37Å; A625-M629 WeakPolarHBondContact O-CB 3.24Å; A625-M629 WeakPolarHBondContact O-CG 3.14Å; A625-M629 PolarHBondContact O-N 2.71Å; V626-M629 PolarHBondContact O-N 2.65Å; L627-M629 VanDerWaalsContact C-N 3.29Å; L627-M629 PolarHBondContact O-N 3.17Å; M629-C633 WeakPolarHBondContact O-CB 3.26Å; M629-C633 PolarHBondContact O-N 3.16Å; M629-C633 PolarHBondContact O-SG 3.04Å
630	L	98.9	Very high	98.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.6	-41.6	176.9	-72	163.3	0	0	0	111.9	I419 R422 I423 F426 L467 L540 V626 L627 C633 T634	I419-L630 HydrophobicContact CG2-CD1 3.97Å; R422-L630 HydrophobicContact CB-CB 3.84Å; R422-L630 HydrophobicContact CB-CD1 3.83Å; R422-L630 HydrophobicContact CB-CG 4.44Å; I423-L630 HydrophobicContact CG1-CD1 3.81Å; I423-L630 HydrophobicContact CG1-CD2 3.93Å; F426-L630 HydrophobicContact CB-CD2 4.47Å; F426-L630 HydrophobicContact CD1-CD2 4.09Å; L467-L630 HydrophobicContact CD2-CD2 4.15Å; L540-L630 HydrophobicContact CD1-CD2 3.97Å; L540-L630 HydrophobicContact CD1-CG 4.04Å; L540-L630 HydrophobicContact CD2-CD2 3.95Å; V626-L630 HydrophobicContact CG1-CD1 3.87Å; V626-L630 WeakPolarHBondContact O-CG 3.42Å; V626-L630 PolarHBondContact O-N 2.66Å; L627-L630 PolarHBondContact O-N 2.73Å; L630-C633 PolarHBondContact O-N 2.92Å; L630-T634 VanDerWaalsContact O-CB 3.31Å; L630-T634 WeakPolarHBondContact O-CB 3.49Å; L630-T634 PolarHBondContact O-N 3.29Å; L630-T634 PolarHBondContact O-OG1 2.9Å
631	E	98.4	Very high	98.2	Very high	80 Å²	80	33.4 Å²	33.4	37%	0.374	17%	0.173	S	C	.	.	H	α-helix	trans	-60.7	-50.5	175.4	-73.2	166.3	177.6	0	0	111.5	R422 L627 C633 T634 E635	R422-E631 HydrophobicContact CG-CG 4.46Å; R422-E631 IonicContact CZ-OE1 3.49Å; R422-E631 VanDerWaalsContact NE-CG 3.34Å; R422-E631 IonicContact NE-OE1 2.76Å; R422-E631 PolarHBondContact NE-OE1 3.34Å; R422-E631 IonicContact NH2-OE1 3.58Å; R422-E631 PolarHBondContact NH2-OE1 3.5Å; L627-E631 VanDerWaalsContact O-CG 3.32Å; L627-E631 WeakPolarHBondContact O-CG 3.47Å; L627-E631 PolarHBondContact O-N 2.87Å; E631-C633 PolarHBondContact O-N 2.75Å; E631-T634 WeakPolarHBondContact O-CB 3.24Å; E631-T634 PolarHBondContact O-N 2.88Å; E631-E635 PolarHBondContact O-N 2.87Å
632	V	97.7	Very high	98.2	Very high	45 Å²	45	32 Å²	32	27%	0.273	17%	0.166	S	C	.	.	H	α-helix	trans	-59.8	-44.4	176.2	163.7	0	0	0	0	112	P579 M580 V583 G628 T634 E635 F636	P579-V632 HydrophobicContact CB-CG1 3.41Å; P579-V632 VanDerWaalsContact CB-CG1 3.41Å; M580-V632 HydrophobicContact SD-CG1 4.44Å; V583-V632 HydrophobicContact CG2-CB 4.14Å; V583-V632 HydrophobicContact CG2-CG1 3.64Å; G628-V632 WeakPolarHBondContact O-CB 3.42Å; G628-V632 WeakPolarHBondContact O-CG2 3.38Å; G628-V632 PolarHBondContact O-N 3.07Å; G628-V632 VanDerWaalsContact O-N 3.09Å; V632-T634 VanDerWaalsContact C-N 3.3Å; V632-T634 PolarHBondContact O-N 3.17Å; V632-E635 PolarHBondContact O-N 2.89Å; V632-F636 VanDerWaalsContact O-CB 3.26Å; V632-F636 WeakPolarHBondContact O-CB 3.49Å; V632-F636 PolarHBondContact O-N 2.68Å
633	C	98.7	Very high	98.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-34.1	178.1	-66.3	0	0	0	0	112.2	F426 L540 M629 L630 E631 A637	F426-C633 HydrophobicContact CD1-CB 4.14Å; F426-C633 HydrophobicContact CD2-CB 4Å; F426-C633 HydrophobicContact CE1-CB 3.75Å; F426-C633 HydrophobicContact CE2-CB 3.6Å; F426-C633 WeakPolarHBondContact CE2-O 3.38Å; F426-C633 HydrophobicContact CG-CB 4.28Å; F426-C633 HydrophobicContact CZ-CB 3.48Å; F426-C633 VanDerWaalsContact CZ-CB 3.48Å; L540-C633 HydrophobicContact CD2-CB 4.37Å; M629-C633 WeakPolarHBondContact O-CB 3.26Å; M629-C633 PolarHBondContact O-N 3.16Å; M629-C633 PolarHBondContact O-SG 3.04Å; L630-C633 PolarHBondContact O-N 2.92Å; E631-C633 PolarHBondContact O-N 2.75Å; C633-A637 VanDerWaalsContact O-CB 3.3Å; C633-A637 WeakPolarHBondContact O-CB 3.49Å; C633-A637 PolarHBondContact O-N 2.9Å
634	T	98.6	Very high	98	Very high	14 Å²	14	36.7 Å²	36.7	9%	0.086	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-51.4	175.1	-60.3	0	0	0	0	111	Q425 F426 S429 L630 E631 V632 F636 A637 Q638	Q425-T634 HydrophobicContact CB-CG2 4.42Å; F426-T634 WeakPolarHBondContact CA-OG1 3.29Å; F426-T634 WeakPolarHBondContact CB-OG1 3.14Å; S429-T634 WeakPolarHBondContact OG-CG2 3.49Å; L630-T634 VanDerWaalsContact O-CB 3.31Å; L630-T634 WeakPolarHBondContact O-CB 3.49Å; L630-T634 PolarHBondContact O-N 3.29Å; L630-T634 PolarHBondContact O-OG1 2.9Å; E631-T634 WeakPolarHBondContact O-CB 3.24Å; E631-T634 PolarHBondContact O-N 2.88Å; V632-T634 VanDerWaalsContact C-N 3.3Å; V632-T634 PolarHBondContact O-N 3.17Å; T634-F636 PolarHBondContact O-N 3.13Å; T634-A637 PolarHBondContact O-N 2.72Å; T634-Q638 WeakPolarHBondContact O-CG 3.37Å; T634-Q638 PolarHBondContact O-N 3.46Å
635	E	98	Very high	97.9	Very high	93 Å²	93	37.9 Å²	37.9	44%	0.435	20%	0.199	S	C	.	.	H	α-helix	trans	-62.5	-43.8	178.2	-167.1	-170.6	161	0	0	111.2	V564 E631 V632 A637 Q638 N639	V564-E635 HydrophobicContact CG1-CB 4.47Å; V564-E635 HydrophobicContact CG1-CG 3.81Å; E631-E635 PolarHBondContact O-N 2.87Å; V632-E635 PolarHBondContact O-N 2.89Å; E635-A637 PolarHBondContact O-N 2.73Å; E635-Q638 PolarHBondContact O-N 3.02Å; E635-N639 WeakPolarHBondContact O-CB 3.26Å; E635-N639 PolarHBondContact O-N 3.41Å; E635-N639 PolarHBondContact O-ND2 3.36Å
636	F	98.1	Very high	97.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-42.3	178.7	-161.4	-80.1	0	0	0	111.5	W547 L558 P560 V564 P577 M580 V632 T634 Q638 N639 I640	W547-F636 HydrophobicContact CB-CE1 4.04Å; W547-F636 HydrophobicContact CD2-CD1 4.04Å; W547-F636 HydrophobicContact CD2-CE1 4.02Å; W547-F636 AromaticContact CE3-CD1 3.21Å; W547-F636 HydrophobicContact CE3-CD1 3.21Å; W547-F636 AromaticContact CE3-CE1 3.57Å; W547-F636 HydrophobicContact CE3-CE1 3.57Å; W547-F636 HydrophobicContact CE3-CG 4.13Å; W547-F636 HydrophobicContact CG-CE1 4.27Å; W547-F636 HydrophobicContact CZ3-CB 4.15Å; W547-F636 AromaticContact CZ3-CD1 3.53Å; W547-F636 HydrophobicContact CZ3-CD1 3.53Å; W547-F636 HydrophobicContact CZ3-CE1 4.33Å; W547-F636 HydrophobicContact CZ3-CG 4.23Å; L558-F636 HydrophobicContact CD1-CE1 4.39Å; L558-F636 HydrophobicContact CD2-CE1 4.08Å; L558-F636 HydrophobicContact CD2-CZ 4.24Å; P560-F636 HydrophobicContact CB-CE2 4.25Å; P560-F636 HydrophobicContact CB-CZ 4.17Å; V564-F636 HydrophobicContact CB-CD2 3.73Å; V564-F636 HydrophobicContact CB-CE2 4.36Å; V564-F636 HydrophobicContact CB-CG 4.37Å; V564-F636 HydrophobicContact CG2-CD2 3.67Å; V564-F636 HydrophobicContact CG2-CE2 4.03Å; V564-F636 HydrophobicContact CG2-CG 4.14Å; V564-F636 WeakPolarHBondContact O-CE2 3.23Å; P577-F636 HydrophobicContact CB-CE2 4.16Å; P577-F636 HydrophobicContact CB-CZ 4.03Å; M580-F636 HydrophobicContact CG-CD1 3.89Å; M580-F636 HydrophobicContact CG-CD2 3.58Å; M580-F636 HydrophobicContact CG-CE1 3.82Å; M580-F636 HydrophobicContact CG-CE2 3.55Å; M580-F636 HydrophobicContact CG-CG 3.76Å; M580-F636 HydrophobicContact CG-CZ 3.66Å; M580-F636 HydrophobicContact SD-CB 3.92Å; M580-F636 HydrophobicContact SD-CD1 4.09Å; M580-F636 HydrophobicContact SD-CD2 4.04Å; M580-F636 HydrophobicContact SD-CG 3.77Å; V632-F636 VanDerWaalsContact O-CB 3.26Å; V632-F636 WeakPolarHBondContact O-CB 3.49Å; V632-F636 PolarHBondContact O-N 2.68Å; T634-F636 PolarHBondContact O-N 3.13Å; F636-Q638 VanDerWaalsContact C-N 3.28Å; F636-Q638 PolarHBondContact O-N 3.22Å; F636-N639 PolarHBondContact O-N 3.39Å; F636-N639 VanDerWaalsContact O-N 3.15Å; F636-I640 HydrophobicContact CD1-CD1 4.42Å; F636-I640 HydrophobicContact CD1-CG2 3.56Å; F636-I640 HydrophobicContact CE1-CG2 3.4Å; F636-I640 VanDerWaalsContact CE1-CG2 3.4Å; F636-I640 HydrophobicContact CG-CG2 4.41Å; F636-I640 HydrophobicContact CZ-CG2 4.1Å; F636-I640 WeakPolarHBondContact O-CG1 3.44Å; F636-I640 WeakPolarHBondContact O-CG2 3.37Å; F636-I640 PolarHBondContact O-N 3.34Å
637	A	98.3	Very high	97.7	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	21%	0.213	C	C	.	.	H	α-helix	trans	-58.3	-37.8	175.5	0	0	0	0	0	113.2	F426 W547 C633 T634 E635 I640	F426-A637 HydrophobicContact CE2-CB 4.22Å; W547-A637 HydrophobicContact CH2-CB 3.84Å; C633-A637 VanDerWaalsContact O-CB 3.3Å; C633-A637 WeakPolarHBondContact O-CB 3.49Å; C633-A637 PolarHBondContact O-N 2.9Å; T634-A637 PolarHBondContact O-N 2.72Å; E635-A637 PolarHBondContact O-N 2.73Å; A637-I640 WeakPolarHBondContact O-CG1 3.41Å
638	Q	97.6	Very high	97.5	Very high	118 Å²	118	45.7 Å²	45.7	55%	0.551	23%	0.23	S	C	*	.	H	α-helix	trans	-75.8	-28.2	179.5	-66	168.9	5.9	0	0	112.2	S429 T634 E635 F636	S429-Q638 PolarHBondContact OG-NE2 3.17Å; T634-Q638 WeakPolarHBondContact O-CG 3.37Å; T634-Q638 PolarHBondContact O-N 3.46Å; E635-Q638 PolarHBondContact O-N 3.02Å; F636-Q638 VanDerWaalsContact C-N 3.28Å; F636-Q638 PolarHBondContact O-N 3.22Å
639	N	97.8	Very high	97.3	Very high	55 Å²	55	48.9 Å²	48.9	29%	0.294	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	19.7	-170.8	-75.3	-84.6	0	0	0	114.6	S561 S563 V564 E635 F636	S561-N639 WeakPolarHBondContact CB-O 3.37Å; S561-N639 PolarHBondContact N-O 3.34Å; S563-N639 PolarHBondContact OG-OD1 3.22Å; V564-N639 HydrophobicContact CB-CB 4.33Å; V564-N639 HydrophobicContact CG1-CB 3.62Å; V564-N639 HydrophobicContact CG2-CB 3.71Å; E635-N639 WeakPolarHBondContact O-CB 3.26Å; E635-N639 PolarHBondContact O-N 3.41Å; E635-N639 PolarHBondContact O-ND2 3.36Å; F636-N639 PolarHBondContact O-N 3.39Å; F636-N639 VanDerWaalsContact O-N 3.15Å
640	I	97.4	Very high	96.9	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	157.4	173.9	52.8	178.6	0	0	0	113.8	L433 W547 L558 P560 F636 A637 F642	L433-I640 HydrophobicContact CD1-CG1 4.22Å; L433-I640 HydrophobicContact CD2-CD1 3.67Å; L433-I640 HydrophobicContact CD2-CG1 4.12Å; W547-I640 HydrophobicContact CD2-CD1 4.43Å; W547-I640 HydrophobicContact CH2-CD1 4.31Å; W547-I640 HydrophobicContact CZ2-CD1 3.96Å; L558-I640 HydrophobicContact CD1-CB 4.34Å; L558-I640 HydrophobicContact CD1-CD1 3.69Å; L558-I640 HydrophobicContact CD1-CG2 4.15Å; L558-I640 HydrophobicContact CD2-CG2 3.84Å; L558-I640 HydrophobicContact CG-CB 4.25Å; L558-I640 HydrophobicContact CG-CD1 4.49Å; L558-I640 HydrophobicContact CG-CG2 4.07Å; P560-I640 HydrophobicContact CB-CG2 4.32Å; F636-I640 HydrophobicContact CD1-CD1 4.42Å; F636-I640 HydrophobicContact CD1-CG2 3.56Å; F636-I640 HydrophobicContact CE1-CG2 3.4Å; F636-I640 VanDerWaalsContact CE1-CG2 3.4Å; F636-I640 HydrophobicContact CG-CG2 4.41Å; F636-I640 HydrophobicContact CZ-CG2 4.1Å; F636-I640 WeakPolarHBondContact O-CG1 3.44Å; F636-I640 WeakPolarHBondContact O-CG2 3.37Å; F636-I640 PolarHBondContact O-N 3.34Å; A637-I640 WeakPolarHBondContact O-CG1 3.41Å; I640-F642 HydrophobicContact CD1-CE2 4.35Å; I640-F642 HydrophobicContact CD1-CZ 4.07Å
641	S	97.1	Very high	96.6	Very high	51 Å²	51	49.6 Å²	49.6	36%	0.357	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	140.7	168.8	58.6	0	0	0	0	109.9	T559	T559-S641 PolarHBondContact N-O 2.88Å; T559-S641 PolarHBondContact O-N 3.33Å; T559-S641 PolarHBondContact O-OG 3.4Å
642	F	98.1	Very high	96	Very high	8 Å²	8	48.9 Å²	48.9	4%	0.035	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.9	171.2	-64.4	-79.2	0	0	0	110.2	L433 Y437 L440 L456 L460 W550 F557 L558 I640 S644 I647	L433-F642 HydrophobicContact CD1-CD2 4.4Å; L433-F642 HydrophobicContact CD1-CE2 3.85Å; L433-F642 HydrophobicContact CD2-CE2 3.87Å; L433-F642 HydrophobicContact CD2-CZ 4.25Å; L433-F642 HydrophobicContact CG-CE2 3.92Å; Y437-F642 HydrophobicContact CD1-CB 4.45Å; Y437-F642 AromaticContact CD2-CD2 3.74Å; Y437-F642 HydrophobicContact CD2-CD2 3.74Å; Y437-F642 HydrophobicContact CD2-CE2 4.4Å; Y437-F642 HydrophobicContact CE1-CB 4.05Å; Y437-F642 HydrophobicContact CE2-CB 4.44Å; Y437-F642 AromaticContact CE2-CD2 3.62Å; Y437-F642 HydrophobicContact CE2-CD2 3.62Å; Y437-F642 HydrophobicContact CE2-CE2 4.45Å; Y437-F642 HydrophobicContact CG-CD2 4.3Å; Y437-F642 PolarHBondContact OH-N 3.01Å; Y437-F642 VanDerWaalsContact OH-N 3.08Å; L440-F642 HydrophobicContact CD2-CB 3.94Å; L456-F642 HydrophobicContact CD1-CE1 4.18Å; L456-F642 HydrophobicContact CD1-CE2 4.5Å; L456-F642 HydrophobicContact CD1-CZ 4.13Å; L456-F642 HydrophobicContact CD2-CB 4.23Å; L456-F642 HydrophobicContact CD2-CD1 4.03Å; L456-F642 HydrophobicContact CD2-CD2 3.48Å; L456-F642 VanDerWaalsContact CD2-CD2 3.48Å; L456-F642 HydrophobicContact CD2-CE1 4.24Å; L456-F642 HydrophobicContact CD2-CE2 3.71Å; L456-F642 HydrophobicContact CD2-CG 3.64Å; L456-F642 HydrophobicContact CD2-CZ 4.1Å; L460-F642 HydrophobicContact CD1-CE2 4.47Å; W550-F642 HydrophobicContact CE3-CD1 4.03Å; W550-F642 AromaticContact CE3-CE1 3.67Å; W550-F642 HydrophobicContact CE3-CE1 3.67Å; W550-F642 AromaticContact CZ3-CD1 3.97Å; W550-F642 HydrophobicContact CZ3-CD1 3.97Å; W550-F642 AromaticContact CZ3-CE1 3.59Å; W550-F642 HydrophobicContact CZ3-CE1 3.59Å; F557-F642 CarbonylContact O-C 3.56Å; F557-F642 VanDerWaalsContact O-CA 3.3Å; F557-F642 WeakPolarHBondContact O-CA 3.32Å; L558-F642 HydrophobicContact CB-CD1 4.29Å; L558-F642 HydrophobicContact CB-CE1 4.26Å; L558-F642 HydrophobicContact CD1-CE1 3.87Å; L558-F642 HydrophobicContact CD1-CZ 4.27Å; L558-F642 HydrophobicContact CG-CE1 4.38Å; I640-F642 HydrophobicContact CD1-CE2 4.35Å; I640-F642 HydrophobicContact CD1-CZ 4.07Å; F642-S644 PolarHBondContact O-N 3.04Å; F642-S644 VanDerWaalsContact O-N 3.11Å; F642-I647 HydrophobicContact CB-CD1 4.04Å
643	N	97.2	Very high	95	Very high	64 Å²	64	49.5 Å²	49.5	34%	0.342	27%	0.266	S	S	.	.			trans	-85.6	79.4	-178	-176.1	-10	0	0	0	109.8	G556 F557 K645 R646 I647	G556-N643 WeakPolarHBondContact O-CB 3.15Å; G556-N643 PolarHBondContact O-ND2 3.34Å; F557-N643 PolarHBondContact O-N 2.84Å; N643-K645 PolarHBondContact O-N 3.3Å; N643-R646 HydrophobicContact CB-CB 4.1Å; N643-R646 VanDerWaalsContact CG-CB 3.47Å; N643-R646 WeakPolarHBondContact ND2-CB 3.39Å; N643-R646 PolarHBondContact O-N 3.07Å; N643-R646 PolarHBondContact OD1-N 3.17Å; N643-R646 VanDerWaalsContact OD1-N 3.16Å; N643-I647 WeakPolarHBondContact O-CG1 3.42Å; N643-I647 PolarHBondContact O-N 3.49Å
644	S	95.9	Very high	94.3	Very high	41 Å²	41	51.1 Å²	51.1	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-51.9	-33.7	-176.2	-45.2	0	0	0	0	113.1	F642 Q648	F642-S644 PolarHBondContact O-N 3.04Å; F642-S644 VanDerWaalsContact O-N 3.11Å; S644-Q648 VanDerWaalsContact O-CB 3.23Å; S644-Q648 WeakPolarHBondContact O-CB 3.23Å; S644-Q648 WeakPolarHBondContact O-CG 3.32Å; S644-Q648 PolarHBondContact O-N 3.47Å; S644-Q648 PolarHBondContact O-OE1 3.07Å
645	K	96.1	Very high	93.9	Very high	170 Å²	170	51.9 Å²	51.9	74%	0.739	28%	0.284	S	S	*	.	H	α-helix	trans	-68.2	-45.6	177.7	-68	-177.7	179	178.3	0	112.5	N643 S649	N643-K645 PolarHBondContact O-N 3.3Å; K645-S649 WeakPolarHBondContact O-CB 3.22Å; K645-S649 PolarHBondContact O-N 3.17Å; K645-S649 PolarHBondContact O-OG 3.47Å
646	R	95.9	Very high	93.7	Very high	84 Å²	84	47.6 Å²	47.6	32%	0.317	27%	0.265	S	S	.	.	H	α-helix	trans	-65.7	-42.9	176.1	177.5	57.8	171.9	-120.5	-6.3	110.8	E553 E554 F555 G556 F557 N643 S649 S650	E553-R646 PolarHBondContact O-NH2 3.13Å; E554-R646 PolarHBondContact O-NH2 2.81Å; F555-R646 VanDerWaalsContact O-CG 3.27Å; F555-R646 WeakPolarHBondContact O-CG 3.35Å; F555-R646 PolarHBondContact O-NE 3.33Å; F555-R646 PolarHBondContact O-NH2 2.99Å; G556-R646 WeakPolarHBondContact O-CG 3.4Å; F557-R646 HydrophobicContact CD1-CG 4.22Å; N643-R646 HydrophobicContact CB-CB 4.1Å; N643-R646 VanDerWaalsContact CG-CB 3.47Å; N643-R646 WeakPolarHBondContact ND2-CB 3.39Å; N643-R646 PolarHBondContact O-N 3.07Å; N643-R646 PolarHBondContact OD1-N 3.17Å; N643-R646 VanDerWaalsContact OD1-N 3.16Å; R646-S649 WeakPolarHBondContact CA-OG 3.22Å; R646-S649 PolarHBondContact O-N 3.37Å; R646-S649 PolarHBondContact O-OG 3.11Å; R646-S650 PolarHBondContact O-N 2.98Å; R646-S650 VanDerWaalsContact O-N 3.15Å
647	I	96.8	Very high	93.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-55.5	174.8	-68.5	165.1	0	0	0	110.3	L440 I441 V442 F557 F642 N643 S649 S650 L651	L440-I647 HydrophobicContact CD1-CG2 4.15Å; L440-I647 HydrophobicContact CD2-CD1 4.02Å; I441-I647 WeakPolarHBondContact O-CG2 3.37Å; V442-I647 HydrophobicContact CB-CG2 4.36Å; V442-I647 HydrophobicContact CG1-CD1 4.1Å; V442-I647 HydrophobicContact CG1-CG1 4.48Å; V442-I647 HydrophobicContact CG1-CG2 3.72Å; F557-I647 HydrophobicContact CB-CD1 4.21Å; F557-I647 HydrophobicContact CB-CG1 3.9Å; F557-I647 HydrophobicContact CD1-CG1 3.65Å; F557-I647 HydrophobicContact CD2-CG1 4.42Å; F557-I647 HydrophobicContact CE1-CG1 4.27Å; F557-I647 HydrophobicContact CG-CG1 3.74Å; F642-I647 HydrophobicContact CB-CD1 4.04Å; N643-I647 WeakPolarHBondContact O-CG1 3.42Å; N643-I647 PolarHBondContact O-N 3.49Å; I647-S649 VanDerWaalsContact C-N 3.34Å; I647-S649 PolarHBondContact O-N 3.31Å; I647-S650 WeakPolarHBondContact O-CA 3.37Å; I647-S650 VanDerWaalsContact O-CB 3.29Å; I647-S650 WeakPolarHBondContact O-CB 3.34Å; I647-S650 PolarHBondContact O-N 2.72Å; I647-S650 PolarHBondContact O-OG 2.9Å; I647-L651 PolarHBondContact O-N 3.3Å
648	Q	93.9	Very high	93.4	Very high	112 Å²	112	48.8 Å²	48.8	52%	0.523	27%	0.273	S	S	.	.	H	α-helix	trans	-55.5	-45.4	177.1	-76.9	167.3	-20	0	0	112.3	S644 S650 L651 P652	S644-Q648 VanDerWaalsContact O-CB 3.23Å; S644-Q648 WeakPolarHBondContact O-CB 3.23Å; S644-Q648 WeakPolarHBondContact O-CG 3.32Å; S644-Q648 PolarHBondContact O-N 3.47Å; S644-Q648 PolarHBondContact O-OE1 3.07Å; Q648-S650 PolarHBondContact O-N 3.34Å; Q648-S650 VanDerWaalsContact O-N 3.1Å; Q648-L651 PolarHBondContact O-N 2.97Å; Q648-L651 VanDerWaalsContact O-N 3.17Å; Q648-P652 WeakPolarHBondContact O-CD 3.4Å
649	S	93.3	Very high	93.2	Very high	83 Å²	83	45.4 Å²	45.4	58%	0.58	26%	0.261	S	S	*	.	H	α-helix	trans	-62.5	-18.1	176.8	73.3	0	0	0	0	113.9	K645 R646 I647	K645-S649 WeakPolarHBondContact O-CB 3.22Å; K645-S649 PolarHBondContact O-N 3.17Å; K645-S649 PolarHBondContact O-OG 3.47Å; R646-S649 WeakPolarHBondContact CA-OG 3.22Å; R646-S649 PolarHBondContact O-N 3.37Å; R646-S649 PolarHBondContact O-OG 3.11Å; I647-S649 VanDerWaalsContact C-N 3.34Å; I647-S649 PolarHBondContact O-N 3.31Å
650	S	92.4	Very high	93.1	Very high	8 Å²	8	42.9 Å²	42.9	6%	0.056	25%	0.247	C	C	.	.	H	α-helix	trans	-87.3	-29.8	177.9	86	0	0	0	0	113.2	R450 F557 R646 I647 Q648 A653	R450-S650 PolarHBondContact NH1-O 3.29Å; F557-S650 WeakPolarHBondContact CZ-OG 3.38Å; R646-S650 PolarHBondContact O-N 2.98Å; R646-S650 VanDerWaalsContact O-N 3.15Å; I647-S650 WeakPolarHBondContact O-CA 3.37Å; I647-S650 VanDerWaalsContact O-CB 3.29Å; I647-S650 WeakPolarHBondContact O-CB 3.34Å; I647-S650 PolarHBondContact O-N 2.72Å; I647-S650 PolarHBondContact O-OG 2.9Å; Q648-S650 PolarHBondContact O-N 3.34Å; Q648-S650 VanDerWaalsContact O-N 3.1Å; S650-A653 PolarHBondContact O-N 2.93Å
651	L	92.6	Very high	93	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.2	-169.8	-68.4	173	0	0	0	115.2	I441 P443 I647 Q648 A653 L656 V718	I441-L651 HydrophobicContact CB-CD1 4.11Å; I441-L651 HydrophobicContact CG2-CD1 4.04Å; I441-L651 HydrophobicContact CG2-CD2 4.04Å; P443-L651 HydrophobicContact CB-CD2 4.47Å; I647-L651 PolarHBondContact O-N 3.3Å; Q648-L651 PolarHBondContact O-N 2.97Å; Q648-L651 VanDerWaalsContact O-N 3.17Å; L651-A653 VanDerWaalsContact C-N 3.28Å; L651-A653 PolarHBondContact O-N 3.11Å; L651-L656 HydrophobicContact CB-CD1 4.45Å; L651-L656 HydrophobicContact CD2-CD1 3.88Å; L651-L656 VanDerWaalsContact O-CD1 3.29Å; L651-L656 WeakPolarHBondContact O-CD1 3.39Å; L651-V718 HydrophobicContact CB-CG1 4.37Å; L651-V718 HydrophobicContact CB-CG2 4.37Å; L651-V718 HydrophobicContact CD1-CG2 4Å
652	P	84	Confident	93	Very high	65 Å²	65	40.3 Å²	40.3	42%	0.422	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-29.8	179	-24.5	35.1	0	0	0	113.9	Q648 G654 Q692	Q648-P652 WeakPolarHBondContact O-CD 3.4Å; P652-G654 PolarHBondContact O-N 2.78Å; P652-Q692 HydrophobicContact CB-CG 4.39Å; P652-Q692 PolarHBondContact O-NE2 3.4Å; P652-Q692 PolarHBondContact O-OE1 2.68Å
653	A	78.5	Confident	93	Very high	57 Å²	57	42.6 Å²	42.6	47%	0.471	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	106.3	-176.9	0	0	0	0	0	111.1	R450 S650 L651	R450-A653 VanDerWaalsContact CD-O 3.24Å; R450-A653 WeakPolarHBondContact CD-O 3.43Å; R450-A653 PolarHBondContact NH1-O 3.17Å; S650-A653 PolarHBondContact O-N 2.93Å; L651-A653 VanDerWaalsContact C-N 3.28Å; L651-A653 PolarHBondContact O-N 3.11Å
654	G	82.3	Confident	93	Very high	35 Å²	35	39.7 Å²	39.7	36%	0.361	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	137.2	-2.4	173.8	0	0	0	0	0	116	P652 L656	P652-G654 PolarHBondContact O-N 2.78Å; G654-L656 PolarHBondContact O-N 2.84Å
655	Y	91.7	Very high	93.1	Very high	29 Å²	29	37.8 Å²	37.8	11%	0.114	21%	0.214	C	C	.	.			trans	55.6	48.1	-177.9	-53.9	-66.7	0	0	0	112.7	D657 A658 V683 C686 V687 C691 L693	Y655-D657 PolarHBondContact O-N 2.78Å; Y655-D657 VanDerWaalsContact O-N 3.13Å; Y655-A658 WeakPolarHBondContact O-CB 3.39Å; Y655-A658 PolarHBondContact O-N 3.32Å; Y655-V683 HydrophobicContact CD2-CG1 3.64Å; Y655-V683 HydrophobicContact CD2-CG2 4.47Å; Y655-V683 HydrophobicContact CE2-CG1 3.89Å; Y655-V683 HydrophobicContact CG-CG1 4.22Å; Y655-V683 HydrophobicContact CG-CG2 4.24Å; Y655-C686 HydrophobicContact CD1-CB 4.41Å; Y655-C686 HydrophobicContact CE1-CB 3.5Å; Y655-V687 HydrophobicContact CE2-CG2 3.75Å; Y655-V687 WeakPolarHBondContact OH-CG2 3.4Å; Y655-V687 PolarHBondContact OH-N 2.99Å; Y655-C691 WeakPolarHBondContact CE1-O 3.26Å; Y655-C691 PolarHBondContact OH-O 2.88Å; Y655-L693 HydrophobicContact CD1-CD1 4.37Å; Y655-L693 HydrophobicContact CD1-CG 4.04Å
656	L	93.1	Very high	93.2	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28.4	-175.3	-65.4	-178.9	0	0	0	113.3	P443 R450 P453 L651 G654 A658 V718	P443-L656 HydrophobicContact CB-CD1 4.29Å; R450-L656 HydrophobicContact CB-CD2 4Å; P453-L656 HydrophobicContact CB-CB 4.32Å; P453-L656 HydrophobicContact CB-CD1 4.2Å; P453-L656 WeakPolarHBondContact CD-O 3.37Å; P453-L656 HydrophobicContact CG-CB 4.18Å; L651-L656 HydrophobicContact CB-CD1 4.45Å; L651-L656 HydrophobicContact CD2-CD1 3.88Å; L651-L656 VanDerWaalsContact O-CD1 3.29Å; L651-L656 WeakPolarHBondContact O-CD1 3.39Å; G654-L656 PolarHBondContact O-N 2.84Å; L656-A658 VanDerWaalsContact C-N 3.3Å; L656-V718 HydrophobicContact CB-CG1 4.08Å; L656-V718 HydrophobicContact CD1-CG1 4.08Å
657	D	94.4	Very high	93.2	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.037	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	0.3	176.4	55.9	-19.2	0	0	0	114.3	Y655 T659 T660 L661 L716 G717 A721	Y655-D657 PolarHBondContact O-N 2.78Å; Y655-D657 VanDerWaalsContact O-N 3.13Å; D657-T659 VanDerWaalsContact C-N 3.32Å; D657-T659 PolarHBondContact O-N 2.75Å; D657-T660 PolarHBondContact O-N 3.22Å; D657-T660 PolarHBondContact O-OG1 2.9Å; D657-T660 VanDerWaalsContact O-OG1 3.04Å; D657-L661 PolarHBondContact O-N 3.42Å; D657-L716 HydrophobicContact CB-CD2 4.39Å; D657-L716 WeakPolarHBondContact OD2-CA 3.18Å; D657-G717 PolarHBondContact OD2-N 3.25Å; D657-A721 HydrophobicContact CB-CB 4.25Å
658	A	94.7	Very high	93.3	Very high	20 Å²	20	37.5 Å²	37.5	17%	0.165	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-34.8	178.5	0	0	0	0	0	113.3	Y655 L656 A662 V679 V683 L693	Y655-A658 WeakPolarHBondContact O-CB 3.39Å; Y655-A658 PolarHBondContact O-N 3.32Å; L656-A658 VanDerWaalsContact C-N 3.3Å; A658-A662 PolarHBondContact O-N 3.05Å; A658-V679 HydrophobicContact CB-CG1 3.81Å; A658-V679 WeakPolarHBondContact O-CG1 3.2Å; A658-V683 HydrophobicContact CB-CG2 4.27Å; A658-L693 HydrophobicContact CB-CD1 3.91Å
659	T	93.7	Very high	93.4	Very high	47 Å²	47	35.1 Å²	35.1	29%	0.288	23%	0.226	S	C	.	.	H	α-helix	trans	-70.5	-41.2	176.2	-40	0	0	0	0	111.8	Q452 D657 L661 A662 D663	Q452-T659 VanDerWaalsContact NE2-CB 3.3Å; Q452-T659 PolarHBondContact NE2-OG1 3.23Å; D657-T659 VanDerWaalsContact C-N 3.32Å; D657-T659 PolarHBondContact O-N 2.75Å; T659-L661 PolarHBondContact O-N 3.2Å; T659-A662 CarbonylContact O-C 3.49Å; T659-A662 WeakPolarHBondContact O-CA 3.37Å; T659-A662 VanDerWaalsContact O-CB 3.3Å; T659-A662 WeakPolarHBondContact O-CB 3.46Å; T659-A662 PolarHBondContact O-N 3.21Å; T659-D663 PolarHBondContact O-N 2.89Å
660	T	95.4	Very high	93.6	Very high	2 Å²	2	32 Å²	32	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-70.2	-25.3	179.4	46.7	0	0	0	0	112	D657 D663 Y664 Y715 A721 K724 F725	D657-T660 PolarHBondContact O-N 3.22Å; D657-T660 PolarHBondContact O-OG1 2.9Å; D657-T660 VanDerWaalsContact O-OG1 3.04Å; T660-D663 PolarHBondContact O-N 2.82Å; T660-Y664 PolarHBondContact O-N 3.34Å; T660-Y715 WeakPolarHBondContact CB-O 3.47Å; T660-Y715 VanDerWaalsContact O-CD1 3.32Å; T660-Y715 WeakPolarHBondContact O-CD1 3.4Å; T660-Y715 PolarHBondContact OG1-O 2.66Å; T660-A721 HydrophobicContact CG2-CB 3.94Å; T660-A721 WeakPolarHBondContact OG1-CB 3.17Å; T660-K724 HydrophobicContact CG2-CB 4.22Å; T660-F725 HydrophobicContact CG2-CE2 4.47Å; T660-F725 HydrophobicContact CG2-CZ 4.37Å
661	L	96.9	Very high	93.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-35.1	164.8	-169.4	62.5	0	0	0	113	D657 T659 Y664 L665 V679 L693 F708 V712 L716	D657-L661 PolarHBondContact O-N 3.42Å; T659-L661 PolarHBondContact O-N 3.2Å; L661-Y664 WeakPolarHBondContact O-CB 3.46Å; L661-L665 WeakPolarHBondContact O-CG 3.44Å; L661-L665 PolarHBondContact O-N 2.86Å; L661-V679 HydrophobicContact CB-CG2 4.01Å; L661-V679 HydrophobicContact CD2-CG2 4.03Å; L661-V679 HydrophobicContact CG-CG2 3.87Å; L661-L693 HydrophobicContact CD2-CD1 4.29Å; L661-L693 HydrophobicContact CD2-CD2 3.89Å; L661-F708 HydrophobicContact CD1-CD1 4.45Å; L661-F708 HydrophobicContact CD1-CE1 3.57Å; L661-F708 HydrophobicContact CD1-CZ 4.22Å; L661-F708 HydrophobicContact CG-CE1 4.23Å; L661-F708 HydrophobicContact CG-CZ 4.45Å; L661-V712 HydrophobicContact CD1-CG2 3.35Å; L661-L716 HydrophobicContact CB-CD2 4.04Å; L661-L716 HydrophobicContact CD1-CD1 4.41Å; L661-L716 HydrophobicContact CD1-CD2 3.89Å; L661-L716 HydrophobicContact CD1-CG 4.28Å; L661-L716 HydrophobicContact CD2-CD2 4.19Å; L661-L716 HydrophobicContact CG-CD2 4.26Å
662	A	97.3	Very high	94.1	Very high	4 Å²	4	41 Å²	41	3%	0.033	25%	0.25	C	S	.	.	H	α-helix	trans	-68.9	-40.9	172.5	0	0	0	0	0	111.3	A658 T659 Y664 L665 V666 F672 V679	A658-A662 PolarHBondContact O-N 3.05Å; T659-A662 CarbonylContact O-C 3.49Å; T659-A662 WeakPolarHBondContact O-CA 3.37Å; T659-A662 VanDerWaalsContact O-CB 3.3Å; T659-A662 WeakPolarHBondContact O-CB 3.46Å; T659-A662 PolarHBondContact O-N 3.21Å; A662-Y664 VanDerWaalsContact C-N 3.33Å; A662-Y664 PolarHBondContact O-N 2.8Å; A662-L665 PolarHBondContact O-N 3Å; A662-V666 WeakPolarHBondContact O-CG2 3.26Å; A662-V666 PolarHBondContact O-N 3.18Å; A662-F672 HydrophobicContact CB-CE2 4.29Å; A662-V679 HydrophobicContact CB-CG2 3.96Å
663	D	96.7	Very high	94.7	Very high	56 Å²	56	46.3 Å²	46.3	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-64.5	-36.1	175.7	-67.2	-35.3	0	0	0	112.2	T659 T660 V666 K667	T659-D663 PolarHBondContact O-N 2.89Å; T660-D663 PolarHBondContact O-N 2.82Å; D663-V666 PolarHBondContact O-N 3.47Å; D663-K667 WeakPolarHBondContact O-CB 3.18Å; D663-K667 VanDerWaalsContact O-CG 3.31Å; D663-K667 WeakPolarHBondContact O-CG 3.49Å; D663-K667 PolarHBondContact O-N 2.93Å
664	Y	97.8	Very high	95.6	Very high	3 Å²	3	46.2 Å²	46.2	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-56.7	-50.4	170	170.5	-93.9	0	0	0	111.4	T660 L661 A662 V666 K667 K668 F708 E709 D711 V712 Y715	T660-Y664 PolarHBondContact O-N 3.34Å; L661-Y664 WeakPolarHBondContact O-CB 3.46Å; A662-Y664 VanDerWaalsContact C-N 3.33Å; A662-Y664 PolarHBondContact O-N 2.8Å; Y664-V666 VanDerWaalsContact C-N 3.34Å; Y664-V666 PolarHBondContact O-N 3.2Å; Y664-K667 WeakPolarHBondContact O-CB 3.12Å; Y664-K667 PolarHBondContact O-N 2.98Å; Y664-K667 VanDerWaalsContact O-N 3.13Å; Y664-K668 HydrophobicContact CD1-CG 4.4Å; Y664-K668 HydrophobicContact CE1-CG 3.98Å; Y664-K668 HydrophobicContact CE2-CG 4.42Å; Y664-K668 PolarHBondContact O-N 3.31Å; Y664-K668 WeakPolarHBondContact OH-CE 3.49Å; Y664-F708 HydrophobicContact CD1-CD1 4.06Å; Y664-F708 HydrophobicContact CD1-CE1 4Å; Y664-F708 AromaticContact CE1-CD1 3.56Å; Y664-F708 HydrophobicContact CE1-CD1 3.56Å; Y664-F708 AromaticContact CE1-CE1 3.98Å; Y664-F708 HydrophobicContact CE1-CE1 3.98Å; Y664-E709 PolarHBondContact OH-N 3.11Å; Y664-E709 PolarHBondContact OH-O 2.87Å; Y664-D711 HydrophobicContact CE2-CB 4.49Å; Y664-D711 VanDerWaalsContact CE2-OD1 3.27Å; Y664-D711 WeakPolarHBondContact CE2-OD1 3.43Å; Y664-D711 PolarHBondContact OH-OD1 3.27Å; Y664-V712 HydrophobicContact CD1-CB 4.48Å; Y664-V712 HydrophobicContact CD1-CG2 4.02Å; Y664-V712 HydrophobicContact CE1-CB 3.99Å; Y664-V712 HydrophobicContact CE1-CG2 3.92Å; Y664-V712 VanDerWaalsContact CE2-CA 3.49Å; Y664-V712 HydrophobicContact CE2-CB 4.02Å; Y664-V712 HydrophobicContact CE2-CG2 4.49Å; Y664-V712 HydrophobicContact CG-CG2 4.35Å; Y664-Y715 AromaticContact CD2-CD2 3.59Å; Y664-Y715 HydrophobicContact CD2-CD2 3.59Å; Y664-Y715 AromaticContact CD2-CE2 3.79Å; Y664-Y715 HydrophobicContact CD2-CE2 3.79Å; Y664-Y715 HydrophobicContact CD2-CG 4.12Å; Y664-Y715 HydrophobicContact CE2-CD2 4.46Å; Y664-Y715 HydrophobicContact CG-CD2 4.32Å; Y664-Y715 HydrophobicContact CG-CG 4.42Å
665	L	98.2	Very high	96.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-39.5	179.3	-68.6	168.8	0	0	0	111.9	L661 A662 K668 G669 V670 S675 I678 V679 V707 F708	L661-L665 WeakPolarHBondContact O-CG 3.44Å; L661-L665 PolarHBondContact O-N 2.86Å; A662-L665 PolarHBondContact O-N 3Å; L665-K668 CarbonylContact O-C 3.58Å; L665-K668 PolarHBondContact O-N 3.5Å; L665-G669 PolarHBondContact O-N 2.93Å; L665-V670 HydrophobicContact CB-CB 4.24Å; L665-V670 WeakPolarHBondContact O-CB 3.32Å; L665-V670 PolarHBondContact O-N 2.91Å; L665-S675 WeakPolarHBondContact CB-OG 3.45Å; L665-S675 WeakPolarHBondContact CD1-O 3.35Å; L665-I678 HydrophobicContact CD1-CB 3.74Å; L665-I678 HydrophobicContact CD1-CD1 4.23Å; L665-I678 HydrophobicContact CD1-CG2 3.55Å; L665-I678 HydrophobicContact CD2-CD1 4.4Å; L665-I678 HydrophobicContact CD2-CG2 4.34Å; L665-V679 HydrophobicContact CD1-CG2 3.97Å; L665-V707 HydrophobicContact CD2-CG1 3.32Å; L665-F708 HydrophobicContact CD1-CE1 4.39Å; L665-F708 HydrophobicContact CD1-CZ 4.03Å; L665-F708 HydrophobicContact CD2-CD1 4.31Å; L665-F708 HydrophobicContact CD2-CE1 3.67Å; L665-F708 HydrophobicContact CD2-CE2 4.41Å; L665-F708 HydrophobicContact CD2-CZ 3.76Å; L665-F708 HydrophobicContact CG-CE1 4.08Å; L665-F708 HydrophobicContact CG-CZ 4.19Å
666	V	97.9	Very high	96.6	Very high	61 Å²	61	48.4 Å²	48.4	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-62.5	-40.4	172.8	172.4	0	0	0	0	111.7	A662 D663 Y664 K668 G669 V670 F672	A662-V666 WeakPolarHBondContact O-CG2 3.26Å; A662-V666 PolarHBondContact O-N 3.18Å; D663-V666 PolarHBondContact O-N 3.47Å; Y664-V666 VanDerWaalsContact C-N 3.34Å; Y664-V666 PolarHBondContact O-N 3.2Å; V666-K668 VanDerWaalsContact C-N 3.32Å; V666-K668 PolarHBondContact O-N 3.33Å; V666-G669 WeakPolarHBondContact O-CA 3.2Å; V666-G669 PolarHBondContact O-N 3.33Å; V666-V670 WeakPolarHBondContact CA-O 3.5Å; V666-F672 HydrophobicContact CG2-CB 4.07Å; V666-F672 HydrophobicContact CG2-CD2 4.03Å
667	K	96.6	Very high	96.8	Very high	125 Å²	125	54 Å²	54	54%	0.543	28%	0.283	S	S	.	.	H	α-helix	trans	-67.5	-28.5	174	-71.6	174.6	-171.2	-173.5	0	113.3	D663 Y664 G669 Y715	D663-K667 WeakPolarHBondContact O-CB 3.18Å; D663-K667 VanDerWaalsContact O-CG 3.31Å; D663-K667 WeakPolarHBondContact O-CG 3.49Å; D663-K667 PolarHBondContact O-N 2.93Å; Y664-K667 WeakPolarHBondContact O-CB 3.12Å; Y664-K667 PolarHBondContact O-N 2.98Å; Y664-K667 VanDerWaalsContact O-N 3.13Å; K667-G669 PolarHBondContact O-N 3.19Å; K667-Y715 HydrophobicContact CD-CE1 4.05Å; K667-Y715 WeakPolarHBondContact CD-OH 3.38Å; K667-Y715 PolarHBondContact NZ-OH 3.12Å
668	K	97.5	Very high	97	Very high	63 Å²	63	53.7 Å²	53.7	27%	0.274	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	3.7	167.3	-63.7	-70.1	-172.5	-177.5	0	113.4	Y664 L665 V666 V707 E709 D711	Y664-K668 HydrophobicContact CD1-CG 4.4Å; Y664-K668 HydrophobicContact CE1-CG 3.98Å; Y664-K668 HydrophobicContact CE2-CG 4.42Å; Y664-K668 PolarHBondContact O-N 3.31Å; Y664-K668 WeakPolarHBondContact OH-CE 3.49Å; L665-K668 CarbonylContact O-C 3.58Å; L665-K668 PolarHBondContact O-N 3.5Å; V666-K668 VanDerWaalsContact C-N 3.32Å; V666-K668 PolarHBondContact O-N 3.33Å; K668-V707 HydrophobicContact CB-CG2 3.8Å; K668-V707 HydrophobicContact CG-CG2 4.29Å; K668-E709 IonicContact NZ-OE2 2.66Å; K668-E709 PolarHBondContact NZ-OE2 3.06Å; K668-D711 VanDerWaalsContact CE-OD2 3.32Å; K668-D711 WeakPolarHBondContact CE-OD2 3.44Å; K668-D711 VanDerWaalsContact NZ-CG 3.29Å; K668-D711 IonicContact NZ-OD1 2.81Å; K668-D711 PolarHBondContact NZ-OD1 2.77Å; K668-D711 VanDerWaalsContact NZ-OD1 3.12Å; K668-D711 IonicContact NZ-OD2 3.21Å; K668-D711 PolarHBondContact NZ-OD2 3.3Å
669	G	97.3	Very high	97.1	Very high	62 Å²	62	53.3 Å²	53.3	64%	0.639	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.3	7.6	176	0	0	0	0	0	115.5	L665 V666 K667	L665-G669 PolarHBondContact O-N 2.93Å; V666-G669 WeakPolarHBondContact O-CA 3.2Å; V666-G669 PolarHBondContact O-N 3.33Å; K667-G669 PolarHBondContact O-N 3.19Å
670	V	97.6	Very high	97.2	Very high	18 Å²	18	52 Å²	52	11%	0.109	27%	0.273	C	S	.	.			trans	-78.9	128.6	177.1	-174.6	0	0	0	0	110	L665 V666 T674 S675 I678 V707	L665-V670 HydrophobicContact CB-CB 4.24Å; L665-V670 WeakPolarHBondContact O-CB 3.32Å; L665-V670 PolarHBondContact O-N 2.91Å; V666-V670 WeakPolarHBondContact CA-O 3.5Å; V670-T674 HydrophobicContact CG1-CG2 3.87Å; V670-S675 WeakPolarHBondContact CB-OG 3.47Å; V670-S675 WeakPolarHBondContact CG1-OG 3.34Å; V670-S675 PolarHBondContact O-OG 3.36Å; V670-S675 VanDerWaalsContact O-OG 3.04Å; V670-I678 HydrophobicContact CG1-CD1 3.94Å; V670-V707 HydrophobicContact CG2-CG1 4.31Å; V670-V707 HydrophobicContact CG2-CG2 4.42Å
671	P	97.5	Very high	97.3	Very high	88 Å²	88	57.6 Å²	57.6	57%	0.571	29%	0.294	S	S	*	.			trans	-59.8	138.9	178.3	-25.8	35.3	0	0	0	112.8	R673 T674 S675	P671-R673 VanDerWaalsContact C-N 3.34Å; P671-R673 PolarHBondContact O-N 3.23Å; P671-R673 VanDerWaalsContact O-N 3.11Å; P671-T674 CarbonylContact O-C 3.55Å; P671-T674 WeakPolarHBondContact O-CA 3.07Å; P671-T674 WeakPolarHBondContact O-CB 3.18Å; P671-T674 PolarHBondContact O-N 2.94Å; P671-S675 PolarHBondContact O-N 2.89Å; P671-S675 PolarHBondContact O-OG 2.87Å
672	F	97.6	Very high	97.3	Very high	117 Å²	117	57.6 Å²	57.6	51%	0.513	29%	0.294	S	S	.	.	H	α-helix	trans	-53	-39.6	-169.9	-179.2	-94.9	0	0	0	115.3	A662 V666 T674 S675 H676	A662-F672 HydrophobicContact CB-CE2 4.29Å; V666-F672 HydrophobicContact CG2-CB 4.07Å; V666-F672 HydrophobicContact CG2-CD2 4.03Å; F672-T674 PolarHBondContact O-N 3.3Å; F672-S675 WeakPolarHBondContact O-CB 3.47Å; F672-S675 PolarHBondContact O-N 3.38Å; F672-H676 WeakPolarHBondContact O-CB 3.32Å; F672-H676 PolarHBondContact O-N 3.04Å
673	R	96.7	Very high	97.2	Very high	175 Å²	175	57.9 Å²	57.9	66%	0.66	30%	0.295	S	S	*	.	H	α-helix	trans	-58.8	-47	175.3	-73.9	-171.9	177.6	-173.5	-1.3	110.8	E78 P671 H676 E677	E78-R673 IonicContact OE2-NH1 2.67Å; E78-R673 IonicContact OE2-NH2 3.12Å; E78-R673 PolarHBondContact OE2-NH2 3.37Å; P671-R673 VanDerWaalsContact C-N 3.34Å; P671-R673 PolarHBondContact O-N 3.23Å; P671-R673 VanDerWaalsContact O-N 3.11Å; R673-H676 WeakPolarHBondContact O-CB 3.43Å; R673-H676 PolarHBondContact O-N 3.41Å; R673-E677 WeakPolarHBondContact O-CG 3.14Å; R673-E677 PolarHBondContact O-N 3Å
674	T	97.7	Very high	97.2	Very high	56 Å²	56	58 Å²	58	34%	0.344	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-36.9	175.7	-49.8	0	0	0	0	112.3	V670 P671 F672 H676 E677 I678	V670-T674 HydrophobicContact CG1-CG2 3.87Å; P671-T674 CarbonylContact O-C 3.55Å; P671-T674 WeakPolarHBondContact O-CA 3.07Å; P671-T674 WeakPolarHBondContact O-CB 3.18Å; P671-T674 PolarHBondContact O-N 2.94Å; F672-T674 PolarHBondContact O-N 3.3Å; T674-H676 VanDerWaalsContact C-N 3.33Å; T674-H676 PolarHBondContact O-N 3.47Å; T674-E677 PolarHBondContact O-N 2.67Å; T674-I678 HydrophobicContact CG2-CD1 4.21Å; T674-I678 WeakPolarHBondContact O-CD1 3.3Å; T674-I678 VanDerWaalsContact O-CG1 3.28Å; T674-I678 WeakPolarHBondContact O-CG1 3.28Å; T674-I678 PolarHBondContact O-N 2.89Å
675	S	98	Very high	97.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.6	-44.3	172.8	-59.6	0	0	0	0	111.6	L665 V670 P671 F672 I678 V679	L665-S675 WeakPolarHBondContact CB-OG 3.45Å; L665-S675 WeakPolarHBondContact CD1-O 3.35Å; V670-S675 WeakPolarHBondContact CB-OG 3.47Å; V670-S675 WeakPolarHBondContact CG1-OG 3.34Å; V670-S675 PolarHBondContact O-OG 3.36Å; V670-S675 VanDerWaalsContact O-OG 3.04Å; P671-S675 PolarHBondContact O-N 2.89Å; P671-S675 PolarHBondContact O-OG 2.87Å; F672-S675 WeakPolarHBondContact O-CB 3.47Å; F672-S675 PolarHBondContact O-N 3.38Å; S675-I678 PolarHBondContact O-N 3.18Å; S675-V679 WeakPolarHBondContact O-CG2 3.48Å; S675-V679 PolarHBondContact O-N 3.37Å
676	H	96.5	Very high	97	Very high	110 Å²	110	59.7 Å²	59.7	51%	0.509	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-40.7	175.3	-179.3	-86	0	0	0	112.2	F672 R673 T674 I678 V679 G680	F672-H676 WeakPolarHBondContact O-CB 3.32Å; F672-H676 PolarHBondContact O-N 3.04Å; R673-H676 WeakPolarHBondContact O-CB 3.43Å; R673-H676 PolarHBondContact O-N 3.41Å; T674-H676 VanDerWaalsContact C-N 3.33Å; T674-H676 PolarHBondContact O-N 3.47Å; H676-I678 VanDerWaalsContact C-N 3.35Å; H676-I678 PolarHBondContact O-N 3.12Å; H676-V679 PolarHBondContact O-N 3.14Å; H676-G680 PolarHBondContact O-N 2.92Å
677	E	96.9	Very high	96.8	Very high	119 Å²	119	60.7 Å²	60.7	56%	0.556	32%	0.319	S	S	*	.	H	α-helix	trans	-64	-35.3	173.5	-70.5	162	-171.1	0	0	113.2	R673 T674 R681	R673-E677 WeakPolarHBondContact O-CG 3.14Å; R673-E677 PolarHBondContact O-N 3Å; T674-E677 PolarHBondContact O-N 2.67Å; E677-R681 WeakPolarHBondContact O-CG 3.41Å; E677-R681 PolarHBondContact O-N 3.33Å; E677-R681 PolarHBondContact O-NE 3.18Å
678	I	97.8	Very high	96.7	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-67.8	-49.8	172.7	-67.6	159.7	0	0	0	109.8	L665 V670 T674 S675 H676 G680 R681 S682 V704 H705 F708	L665-I678 HydrophobicContact CD1-CB 3.74Å; L665-I678 HydrophobicContact CD1-CD1 4.23Å; L665-I678 HydrophobicContact CD1-CG2 3.55Å; L665-I678 HydrophobicContact CD2-CD1 4.4Å; L665-I678 HydrophobicContact CD2-CG2 4.34Å; V670-I678 HydrophobicContact CG1-CD1 3.94Å; T674-I678 HydrophobicContact CG2-CD1 4.21Å; T674-I678 WeakPolarHBondContact O-CD1 3.3Å; T674-I678 VanDerWaalsContact O-CG1 3.28Å; T674-I678 WeakPolarHBondContact O-CG1 3.28Å; T674-I678 PolarHBondContact O-N 2.89Å; S675-I678 PolarHBondContact O-N 3.18Å; H676-I678 VanDerWaalsContact C-N 3.35Å; H676-I678 PolarHBondContact O-N 3.12Å; I678-G680 VanDerWaalsContact C-N 3.35Å; I678-G680 PolarHBondContact O-N 3.39Å; I678-R681 PolarHBondContact O-N 3.09Å; I678-R681 VanDerWaalsContact O-N 3.1Å; I678-S682 PolarHBondContact O-N 3.16Å; I678-S682 PolarHBondContact O-OG 2.7Å; I678-V704 HydrophobicContact CG2-CG1 4.12Å; I678-H705 HydrophobicContact CD1-CB 4.06Å; I678-H705 HydrophobicContact CG1-CB 4.08Å; I678-H705 HydrophobicContact CG2-CB 3.84Å; I678-F708 HydrophobicContact CG2-CE2 3.58Å; I678-F708 HydrophobicContact CG2-CZ 3.64Å
679	V	97.4	Very high	96.5	Very high	11 Å²	11	61 Å²	61	7%	0.067	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-43.7	178.2	170.1	0	0	0	0	111.8	A658 L661 A662 L665 S675 H676 R681 S682 V683	A658-V679 HydrophobicContact CB-CG1 3.81Å; A658-V679 WeakPolarHBondContact O-CG1 3.2Å; L661-V679 HydrophobicContact CB-CG2 4.01Å; L661-V679 HydrophobicContact CD2-CG2 4.03Å; L661-V679 HydrophobicContact CG-CG2 3.87Å; A662-V679 HydrophobicContact CB-CG2 3.96Å; L665-V679 HydrophobicContact CD1-CG2 3.97Å; S675-V679 WeakPolarHBondContact O-CG2 3.48Å; S675-V679 PolarHBondContact O-N 3.37Å; H676-V679 PolarHBondContact O-N 3.14Å; V679-R681 PolarHBondContact O-N 3.4Å; V679-S682 PolarHBondContact O-N 3.04Å; V679-S682 VanDerWaalsContact O-N 3.08Å; V679-V683 HydrophobicContact CG1-CG2 4.27Å; V679-V683 WeakPolarHBondContact O-CG2 3.35Å; V679-V683 PolarHBondContact O-N 3.5Å
680	G	96.6	Very high	96.3	Very high	20 Å²	20	65.3 Å²	65.3	21%	0.206	34%	0.341	C	S	.	.	H	α-helix	trans	-58.9	-34.8	176.5	0	0	0	0	0	112.9	H676 I678 A684	H676-G680 PolarHBondContact O-N 2.92Å; I678-G680 VanDerWaalsContact C-N 3.35Å; I678-G680 PolarHBondContact O-N 3.39Å; G680-A684 WeakPolarHBondContact O-CB 3.48Å; G680-A684 PolarHBondContact O-N 3.08Å
681	R	97.3	Very high	96.1	Very high	119 Å²	119	65.3 Å²	65.3	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-74.6	-37.3	172.9	-68.8	-177.1	-59.9	123.2	3.7	112.6	E677 I678 V679 A684 L685 V704	E677-R681 WeakPolarHBondContact O-CG 3.41Å; E677-R681 PolarHBondContact O-N 3.33Å; E677-R681 PolarHBondContact O-NE 3.18Å; I678-R681 PolarHBondContact O-N 3.09Å; I678-R681 VanDerWaalsContact O-N 3.1Å; V679-R681 PolarHBondContact O-N 3.4Å; R681-A684 PolarHBondContact O-N 2.87Å; R681-L685 WeakPolarHBondContact O-CB 3.36Å; R681-L685 PolarHBondContact O-N 3.24Å; R681-V704 HydrophobicContact CB-CG1 3.59Å; R681-V704 VanDerWaalsContact CZ-O 3.28Å; R681-V704 PolarHBondContact NH1-O 2.65Å; R681-V704 PolarHBondContact NH2-O 2.89Å
682	S	97	Very high	95.9	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-41.2	172	-60.5	0	0	0	0	112.2	I678 V679 L685 C686	I678-S682 PolarHBondContact O-N 3.16Å; I678-S682 PolarHBondContact O-OG 2.7Å; V679-S682 PolarHBondContact O-N 3.04Å; V679-S682 VanDerWaalsContact O-N 3.08Å; S682-L685 WeakPolarHBondContact O-CB 3.29Å; S682-L685 PolarHBondContact O-N 2.87Å; S682-C686 PolarHBondContact O-N 3.12Å; S682-C686 PolarHBondContact O-SG 3.04Å
683	V	95.7	Very high	95.8	Very high	10 Å²	10	57.9 Å²	57.9	6%	0.061	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-42.9	174.1	168.7	0	0	0	0	111	Y655 A658 V679 L685 C686 V687 L693	Y655-V683 HydrophobicContact CD2-CG1 3.64Å; Y655-V683 HydrophobicContact CD2-CG2 4.47Å; Y655-V683 HydrophobicContact CE2-CG1 3.89Å; Y655-V683 HydrophobicContact CG-CG1 4.22Å; Y655-V683 HydrophobicContact CG-CG2 4.24Å; A658-V683 HydrophobicContact CB-CG2 4.27Å; V679-V683 HydrophobicContact CG1-CG2 4.27Å; V679-V683 WeakPolarHBondContact O-CG2 3.35Å; V679-V683 PolarHBondContact O-N 3.5Å; V683-L685 VanDerWaalsContact C-N 3.31Å; V683-L685 PolarHBondContact O-N 3.31Å; V683-C686 WeakPolarHBondContact O-CB 3.38Å; V683-C686 PolarHBondContact O-N 2.93Å; V683-V687 WeakPolarHBondContact O-CG2 3.41Å; V683-V687 PolarHBondContact O-N 3.15Å; V683-L693 HydrophobicContact CG2-CD1 4.12Å; V683-L693 HydrophobicContact CG2-CD2 4.17Å; V683-L693 HydrophobicContact CG2-CG 4.46Å
684	A	95.6	Very high	95.6	Very high	60 Å²	60	51.6 Å²	51.6	50%	0.496	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-38.5	174.2	0	0	0	0	0	112.5	G680 R681 V687 S688	G680-A684 WeakPolarHBondContact O-CB 3.48Å; G680-A684 PolarHBondContact O-N 3.08Å; R681-A684 PolarHBondContact O-N 2.87Å; A684-V687 PolarHBondContact O-N 3.34Å; A684-S688 PolarHBondContact O-N 2.76Å
685	L	96.1	Very high	95.5	Very high	37 Å²	37	55.1 Å²	55.1	19%	0.194	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-46	172.9	-175.9	60.7	0	0	0	111.1	R681 S682 V683 V687 S688 K689 L696 D700 V704	R681-L685 WeakPolarHBondContact O-CB 3.36Å; R681-L685 PolarHBondContact O-N 3.24Å; S682-L685 WeakPolarHBondContact O-CB 3.29Å; S682-L685 PolarHBondContact O-N 2.87Å; V683-L685 VanDerWaalsContact C-N 3.31Å; V683-L685 PolarHBondContact O-N 3.31Å; L685-V687 PolarHBondContact O-N 2.89Å; L685-S688 PolarHBondContact O-N 3.43Å; L685-S688 PolarHBondContact O-OG 3.38Å; L685-K689 HydrophobicContact CD1-CG 4.45Å; L685-K689 PolarHBondContact O-N 2.79Å; L685-L696 HydrophobicContact CD2-CD1 4.3Å; L685-L696 HydrophobicContact CD2-CD2 4.22Å; L685-L696 HydrophobicContact CG-CD2 4.19Å; L685-D700 HydrophobicContact CD2-CB 4.07Å; L685-V704 HydrophobicContact CD2-CG2 3.87Å
686	C	95.3	Very high	95.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.5	-46.8	175.4	-70.1	0	0	0	0	112.7	Y655 S682 V683 S688 K689 N690 C691 L693 L696	Y655-C686 HydrophobicContact CD1-CB 4.41Å; Y655-C686 HydrophobicContact CE1-CB 3.5Å; S682-C686 PolarHBondContact O-N 3.12Å; S682-C686 PolarHBondContact O-SG 3.04Å; V683-C686 WeakPolarHBondContact O-CB 3.38Å; V683-C686 PolarHBondContact O-N 2.93Å; C686-S688 PolarHBondContact O-N 3.36Å; C686-K689 CarbonylContact O-C 3.47Å; C686-K689 PolarHBondContact O-N 3.13Å; C686-N690 WeakPolarHBondContact O-CA 3.41Å; C686-N690 PolarHBondContact O-N 3.31Å; C686-C691 WeakPolarHBondContact CB-O 3.43Å; C686-C691 PolarHBondContact O-N 2.92Å; C686-L693 VanDerWaalsContact SG-CD2 3.56Å; C686-L696 WeakPolarHBondContact SG-CD1 3.33Å
687	V	93.6	Very high	95.3	Very high	83 Å²	83	51.5 Å²	51.5	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-44.8	176	171.2	0	0	0	0	110.8	Y655 V683 A684 L685 K689 N690	Y655-V687 HydrophobicContact CE2-CG2 3.75Å; Y655-V687 WeakPolarHBondContact OH-CG2 3.4Å; Y655-V687 PolarHBondContact OH-N 2.99Å; V683-V687 WeakPolarHBondContact O-CG2 3.41Å; V683-V687 PolarHBondContact O-N 3.15Å; A684-V687 PolarHBondContact O-N 3.34Å; L685-V687 PolarHBondContact O-N 2.89Å; V687-K689 VanDerWaalsContact C-N 3.28Å; V687-K689 PolarHBondContact O-N 3.38Å; V687-N690 PolarHBondContact O-N 3.46Å
688	S	94.6	Very high	95.3	Very high	93 Å²	93	48.1 Å²	48.1	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-64.9	-29.6	178.8	77.2	0	0	0	0	114	A684 L685 C686	A684-S688 PolarHBondContact O-N 2.76Å; L685-S688 PolarHBondContact O-N 3.43Å; L685-S688 PolarHBondContact O-OG 3.38Å; C686-S688 PolarHBondContact O-N 3.36Å
689	K	94.8	Very high	95.3	Very high	100 Å²	100	54.2 Å²	54.2	44%	0.435	31%	0.309	S	S	.	.	H	α-helix	trans	-91.6	-7.6	176.9	-71	-164.1	179.6	-157.7	0	113.7	L685 C686 V687 C691 L696 D700	L685-K689 HydrophobicContact CD1-CG 4.45Å; L685-K689 PolarHBondContact O-N 2.79Å; C686-K689 CarbonylContact O-C 3.47Å; C686-K689 PolarHBondContact O-N 3.13Å; V687-K689 VanDerWaalsContact C-N 3.28Å; V687-K689 PolarHBondContact O-N 3.38Å; K689-C691 HydrophobicContact CB-CB 4.45Å; K689-C691 VanDerWaalsContact CB-SG 3.54Å; K689-L696 HydrophobicContact CD-CD2 4.14Å; K689-D700 IonicContact NZ-OD1 2.69Å; K689-D700 PolarHBondContact NZ-OD1 3.49Å; K689-D700 IonicContact NZ-OD2 2.71Å; K689-D700 PolarHBondContact NZ-OD2 3.47Å
690	N	92.8	Very high	95.3	Very high	153 Å²	153	55.8 Å²	55.8	82%	0.818	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	53.8	-169.8	-169.4	87	0	0	0	112.2	C686 V687	C686-N690 WeakPolarHBondContact O-CA 3.41Å; C686-N690 PolarHBondContact O-N 3.31Å; V687-N690 PolarHBondContact O-N 3.46Å
691	C	93.5	Very high	95.3	Very high	19 Å²	19	54.8 Å²	54.8	13%	0.128	31%	0.307	C	S	.	.			trans	-138.8	177	-179.8	68.4	0	0	0	0	111.7	Y655 C686 K689 E695	Y655-C691 WeakPolarHBondContact CE1-O 3.26Å; Y655-C691 PolarHBondContact OH-O 2.88Å; C686-C691 WeakPolarHBondContact CB-O 3.43Å; C686-C691 PolarHBondContact O-N 2.92Å; K689-C691 HydrophobicContact CB-CB 4.45Å; K689-C691 VanDerWaalsContact CB-SG 3.54Å; C691-E695 VanDerWaalsContact CA-OE2 3.27Å; C691-E695 WeakPolarHBondContact CA-OE2 3.39Å; C691-E695 HydrophobicContact CB-CB 4.06Å; C691-E695 VanDerWaalsContact CB-OE2 3.32Å; C691-E695 WeakPolarHBondContact CB-OE2 3.32Å
692	Q	93.1	Very high	95.3	Very high	48 Å²	48	53.3 Å²	53.3	22%	0.224	30%	0.304	C	S	.	.			trans	-93.6	162.8	174.7	-59.5	-57.7	-24.2	0	0	112.8	P652 A694 E695 L696	P652-Q692 HydrophobicContact CB-CG 4.39Å; P652-Q692 PolarHBondContact O-NE2 3.4Å; P652-Q692 PolarHBondContact O-OE1 2.68Å; Q692-A694 VanDerWaalsContact C-N 3.31Å; Q692-A694 PolarHBondContact O-N 2.78Å; Q692-E695 HydrophobicContact CB-CB 4.38Å; Q692-E695 HydrophobicContact CB-CG 4.02Å; Q692-E695 PolarHBondContact N-OE2 3.28Å; Q692-E695 WeakPolarHBondContact O-CB 3.37Å; Q692-E695 PolarHBondContact O-N 3.01Å; Q692-L696 PolarHBondContact O-N 2.83Å
693	L	94.8	Very high	95.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-59.8	-42.8	175.4	-73.1	167.5	0	0	0	111.5	Y655 A658 L661 V683 C686 E695 L696 L716	Y655-L693 HydrophobicContact CD1-CD1 4.37Å; Y655-L693 HydrophobicContact CD1-CG 4.04Å; A658-L693 HydrophobicContact CB-CD1 3.91Å; L661-L693 HydrophobicContact CD2-CD1 4.29Å; L661-L693 HydrophobicContact CD2-CD2 3.89Å; V683-L693 HydrophobicContact CG2-CD1 4.12Å; V683-L693 HydrophobicContact CG2-CD2 4.17Å; V683-L693 HydrophobicContact CG2-CG 4.46Å; C686-L693 VanDerWaalsContact SG-CD2 3.56Å; L693-E695 PolarHBondContact O-N 3.36Å; L693-L696 PolarHBondContact O-N 2.96Å; L693-L716 HydrophobicContact CB-CD2 3.71Å; L693-L716 HydrophobicContact CD1-CD2 4.49Å
694	A	93.6	Very high	95.3	Very high	44 Å²	44	57.6 Å²	57.6	36%	0.364	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-64.3	-14.8	173.9	0	0	0	0	0	114.9	Q692 L716	Q692-A694 VanDerWaalsContact C-N 3.31Å; Q692-A694 PolarHBondContact O-N 2.78Å; A694-L716 HydrophobicContact CB-CB 4.02Å
695	E	94.4	Very high	95.4	Very high	130 Å²	130	57.4 Å²	57.4	61%	0.607	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-95.1	-8.6	179.1	-67	174.4	151.8	0	0	112.9	C691 Q692 L693	C691-E695 VanDerWaalsContact CA-OE2 3.27Å; C691-E695 WeakPolarHBondContact CA-OE2 3.39Å; C691-E695 HydrophobicContact CB-CB 4.06Å; C691-E695 VanDerWaalsContact CB-OE2 3.32Å; C691-E695 WeakPolarHBondContact CB-OE2 3.32Å; Q692-E695 HydrophobicContact CB-CB 4.38Å; Q692-E695 HydrophobicContact CB-CG 4.02Å; Q692-E695 PolarHBondContact N-OE2 3.28Å; Q692-E695 WeakPolarHBondContact O-CB 3.37Å; Q692-E695 PolarHBondContact O-N 3.01Å; L693-E695 PolarHBondContact O-N 3.36Å
696	L	95.1	Very high	95.4	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.01	35%	0.346	C	S	.	.	S	Bend	trans	-69.3	136.1	173.3	-69.2	-177.2	0	0	0	111.1	L685 C686 K689 Q692 L693 D700 L701 Y713	L685-L696 HydrophobicContact CD2-CD1 4.3Å; L685-L696 HydrophobicContact CD2-CD2 4.22Å; L685-L696 HydrophobicContact CG-CD2 4.19Å; C686-L696 WeakPolarHBondContact SG-CD1 3.33Å; K689-L696 HydrophobicContact CD-CD2 4.14Å; Q692-L696 PolarHBondContact O-N 2.83Å; L693-L696 PolarHBondContact O-N 2.96Å; L696-D700 HydrophobicContact CB-CB 4.21Å; L696-D700 HydrophobicContact CD2-CB 4.18Å; L696-L701 HydrophobicContact CB-CD2 4.16Å; L696-L701 HydrophobicContact CB-CG 4.03Å; L696-L701 HydrophobicContact CD1-CD2 3.7Å; L696-L701 HydrophobicContact CD1-CG 4.37Å; L696-Y713 WeakPolarHBondContact O-CE1 3.3Å; L696-Y713 PolarHBondContact O-OH 2.88Å
697	G	96	Very high	95.5	Very high	32 Å²	32	62.4 Å²	62.4	33%	0.33	36%	0.356	S	S	.	.			trans	-70.1	158.2	171.5	0	0	0	0	0	112.2	D699 D700 L701	G697-D699 PolarHBondContact O-N 3.42Å; G697-D700 PolarHBondContact N-OD2 2.93Å; G697-D700 WeakPolarHBondContact O-CB 3.41Å; G697-D700 PolarHBondContact O-N 3.42Å; G697-L701 PolarHBondContact O-N 3.44Å
698	L	97.1	Very high	95.7	Very high	47 Å²	47	58.4 Å²	58.4	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-32.3	-179.3	-177.1	59.3	0	0	0	111.8	L701 K702 F708 V712 Y713	L698-L701 PolarHBondContact O-N 3.29Å; L698-K702 HydrophobicContact CG-CD 4.2Å; L698-K702 WeakPolarHBondContact O-CB 3.48Å; L698-K702 VanDerWaalsContact O-CG 3.28Å; L698-K702 WeakPolarHBondContact O-CG 3.44Å; L698-K702 PolarHBondContact O-N 3.02Å; L698-F708 HydrophobicContact CD1-CB 4.4Å; L698-V712 HydrophobicContact CD1-CG1 4.48Å; L698-Y713 HydrophobicContact CB-CE2 4.45Å; L698-Y713 PolarHBondContact N-OH 3.29Å
699	D	97.1	Very high	95.8	Very high	130 Å²	130	59.1 Å²	59.1	70%	0.695	33%	0.325	S	S	*	.	H	α-helix	trans	-71.2	-32.7	175.4	-59.4	-40	0	0	0	112.5	G697 S703	G697-D699 PolarHBondContact O-N 3.42Å; D699-S703 WeakPolarHBondContact O-CB 3.28Å; D699-S703 PolarHBondContact O-N 3.01Å
700	D	96.6	Very high	95.9	Very high	44 Å²	44	56.7 Å²	56.7	24%	0.235	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-48.3	171.5	-72.9	-41.5	0	0	0	110.6	L685 K689 L696 G697 K702 S703 V704	L685-D700 HydrophobicContact CD2-CB 4.07Å; K689-D700 IonicContact NZ-OD1 2.69Å; K689-D700 PolarHBondContact NZ-OD1 3.49Å; K689-D700 IonicContact NZ-OD2 2.71Å; K689-D700 PolarHBondContact NZ-OD2 3.47Å; L696-D700 HydrophobicContact CB-CB 4.21Å; L696-D700 HydrophobicContact CD2-CB 4.18Å; G697-D700 PolarHBondContact N-OD2 2.93Å; G697-D700 WeakPolarHBondContact O-CB 3.41Å; G697-D700 PolarHBondContact O-N 3.42Å; D700-K702 PolarHBondContact O-N 3.01Å; D700-S703 WeakPolarHBondContact O-CB 3.21Å; D700-S703 PolarHBondContact O-N 2.78Å; D700-S703 VanDerWaalsContact O-N 3.16Å; D700-S703 PolarHBondContact O-OG 2.97Å; D700-V704 PolarHBondContact O-N 2.99Å
701	L	96.8	Very high	96.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-47.9	176.8	-69.1	171.1	0	0	0	110.4	L696 G697 L698 S703 V704 H705 F708 V712 Y713 L716	L696-L701 HydrophobicContact CB-CD2 4.16Å; L696-L701 HydrophobicContact CB-CG 4.03Å; L696-L701 HydrophobicContact CD1-CD2 3.7Å; L696-L701 HydrophobicContact CD1-CG 4.37Å; G697-L701 PolarHBondContact O-N 3.44Å; L698-L701 PolarHBondContact O-N 3.29Å; L701-S703 VanDerWaalsContact C-N 3.26Å; L701-S703 PolarHBondContact O-N 3.03Å; L701-V704 WeakPolarHBondContact O-CA 3.02Å; L701-V704 WeakPolarHBondContact O-CB 3.16Å; L701-V704 PolarHBondContact O-N 3.16Å; L701-H705 PolarHBondContact O-N 3.29Å; L701-F708 HydrophobicContact CB-CB 3.9Å; L701-F708 HydrophobicContact CB-CD2 3.84Å; L701-F708 HydrophobicContact CB-CE2 4.46Å; L701-F708 HydrophobicContact CB-CG 3.86Å; L701-F708 WeakPolarHBondContact O-CD2 3.3Å; L701-V712 HydrophobicContact CD1-CG1 3.66Å; L701-V712 HydrophobicContact CD1-CG2 4.34Å; L701-Y713 HydrophobicContact CD1-CE1 4.45Å; L701-L716 HydrophobicContact CD1-CD1 4.35Å
702	K	97.5	Very high	96.3	Very high	88 Å²	88	51.2 Å²	51.2	38%	0.383	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-32.2	175.5	-76.6	173.9	178.3	177.2	0	113.6	L698 D700 V704 H705 F708	L698-K702 HydrophobicContact CG-CD 4.2Å; L698-K702 WeakPolarHBondContact O-CB 3.48Å; L698-K702 VanDerWaalsContact O-CG 3.28Å; L698-K702 WeakPolarHBondContact O-CG 3.44Å; L698-K702 PolarHBondContact O-N 3.02Å; D700-K702 PolarHBondContact O-N 3.01Å; K702-V704 PolarHBondContact O-N 3Å; K702-H705 WeakPolarHBondContact CA-O 3.23Å; K702-H705 CarbonylContact O-C 3.3Å; K702-H705 VanDerWaalsContact O-C 3.3Å; K702-H705 PolarHBondContact O-N 2.66Å; K702-F708 WeakPolarHBondContact CE-O 3.22Å; K702-F708 HydrophobicContact CG-CB 4.39Å; K702-F708 WeakPolarHBondContact CG-O 3.16Å
703	S	96.6	Very high	96.5	Very high	86 Å²	86	52.7 Å²	52.7	60%	0.601	30%	0.302	S	S	*	.	H	α-helix	trans	-64.8	-27	173.1	84.2	0	0	0	0	113	D699 D700 L701	D699-S703 WeakPolarHBondContact O-CB 3.28Å; D699-S703 PolarHBondContact O-N 3.01Å; D700-S703 WeakPolarHBondContact O-CB 3.21Å; D700-S703 PolarHBondContact O-N 2.78Å; D700-S703 VanDerWaalsContact O-N 3.16Å; D700-S703 PolarHBondContact O-OG 2.97Å; L701-S703 VanDerWaalsContact C-N 3.26Å; L701-S703 PolarHBondContact O-N 3.03Å
704	V	97	Very high	96.5	Very high	14 Å²	14	57.5 Å²	57.5	9%	0.085	33%	0.325	C	S	.	.	H	α-helix	trans	-79.7	-44.9	172.1	-173.1	0	0	0	0	111	I678 R681 L685 D700 L701 K702	I678-V704 HydrophobicContact CG2-CG1 4.12Å; R681-V704 HydrophobicContact CB-CG1 3.59Å; R681-V704 VanDerWaalsContact CZ-O 3.28Å; R681-V704 PolarHBondContact NH1-O 2.65Å; R681-V704 PolarHBondContact NH2-O 2.89Å; L685-V704 HydrophobicContact CD2-CG2 3.87Å; D700-V704 PolarHBondContact O-N 2.99Å; L701-V704 WeakPolarHBondContact O-CA 3.02Å; L701-V704 WeakPolarHBondContact O-CB 3.16Å; L701-V704 PolarHBondContact O-N 3.16Å; K702-V704 PolarHBondContact O-N 3Å
705	H	96.6	Very high	96.6	Very high	56 Å²	56	56.6 Å²	56.6	26%	0.259	31%	0.312	S	S	.	.			trans	-158.4	133.4	174.2	-161.9	-107.5	0	0	0	112.5	I678 L701 K702 V707 F708	I678-H705 HydrophobicContact CD1-CB 4.06Å; I678-H705 HydrophobicContact CG1-CB 4.08Å; I678-H705 HydrophobicContact CG2-CB 3.84Å; L701-H705 PolarHBondContact O-N 3.29Å; K702-H705 WeakPolarHBondContact CA-O 3.23Å; K702-H705 CarbonylContact O-C 3.3Å; K702-H705 VanDerWaalsContact O-C 3.3Å; K702-H705 PolarHBondContact O-N 2.66Å; H705-V707 WeakPolarHBondContact ND1-CB 3.25Å; H705-V707 WeakPolarHBondContact ND1-CG1 3.3Å; H705-V707 PolarHBondContact O-N 3.37Å; H705-F708 HydrophobicContact CB-CD2 4.26Å; H705-F708 HydrophobicContact CB-CE2 4.12Å; H705-F708 VanDerWaalsContact O-CD2 3.24Å; H705-F708 WeakPolarHBondContact O-CD2 3.32Å; H705-F708 PolarHBondContact O-N 3.27Å
706	P	96.7	Very high	96.7	Very high	105 Å²	105	50.6 Å²	50.6	68%	0.682	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-5.5	-172.7	27.8	-36.7	0	0	0	115.5	F708	P706-F708 VanDerWaalsContact C-N 3.27Å; P706-F708 PolarHBondContact O-N 2.86Å
707	V	96.9	Very high	96.6	Very high	36 Å²	36	51.4 Å²	51.4	22%	0.218	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-10.9	179.2	82.5	0	0	0	0	113.9	L665 K668 V670 H705 E709	L665-V707 HydrophobicContact CD2-CG1 3.32Å; K668-V707 HydrophobicContact CB-CG2 3.8Å; K668-V707 HydrophobicContact CG-CG2 4.29Å; V670-V707 HydrophobicContact CG2-CG1 4.31Å; V670-V707 HydrophobicContact CG2-CG2 4.42Å; H705-V707 WeakPolarHBondContact ND1-CB 3.25Å; H705-V707 WeakPolarHBondContact ND1-CG1 3.3Å; H705-V707 PolarHBondContact O-N 3.37Å; V707-E709 PolarHBondContact O-N 3.05Å
708	F	97.7	Very high	96.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.282	C	S	.	.			trans	-73.9	121.8	-179.5	-71.4	-66	0	0	0	111.4	L661 Y664 L665 I678 L698 L701 K702 H705 P706 V712	L661-F708 HydrophobicContact CD1-CD1 4.45Å; L661-F708 HydrophobicContact CD1-CE1 3.57Å; L661-F708 HydrophobicContact CD1-CZ 4.22Å; L661-F708 HydrophobicContact CG-CE1 4.23Å; L661-F708 HydrophobicContact CG-CZ 4.45Å; Y664-F708 HydrophobicContact CD1-CD1 4.06Å; Y664-F708 HydrophobicContact CD1-CE1 4Å; Y664-F708 AromaticContact CE1-CD1 3.56Å; Y664-F708 HydrophobicContact CE1-CD1 3.56Å; Y664-F708 AromaticContact CE1-CE1 3.98Å; Y664-F708 HydrophobicContact CE1-CE1 3.98Å; L665-F708 HydrophobicContact CD1-CE1 4.39Å; L665-F708 HydrophobicContact CD1-CZ 4.03Å; L665-F708 HydrophobicContact CD2-CD1 4.31Å; L665-F708 HydrophobicContact CD2-CE1 3.67Å; L665-F708 HydrophobicContact CD2-CE2 4.41Å; L665-F708 HydrophobicContact CD2-CZ 3.76Å; L665-F708 HydrophobicContact CG-CE1 4.08Å; L665-F708 HydrophobicContact CG-CZ 4.19Å; I678-F708 HydrophobicContact CG2-CE2 3.58Å; I678-F708 HydrophobicContact CG2-CZ 3.64Å; L698-F708 HydrophobicContact CD1-CB 4.4Å; L701-F708 HydrophobicContact CB-CB 3.9Å; L701-F708 HydrophobicContact CB-CD2 3.84Å; L701-F708 HydrophobicContact CB-CE2 4.46Å; L701-F708 HydrophobicContact CB-CG 3.86Å; L701-F708 WeakPolarHBondContact O-CD2 3.3Å; K702-F708 WeakPolarHBondContact CE-O 3.22Å; K702-F708 HydrophobicContact CG-CB 4.39Å; K702-F708 WeakPolarHBondContact CG-O 3.16Å; H705-F708 HydrophobicContact CB-CD2 4.26Å; H705-F708 HydrophobicContact CB-CE2 4.12Å; H705-F708 VanDerWaalsContact O-CD2 3.24Å; H705-F708 WeakPolarHBondContact O-CD2 3.32Å; H705-F708 PolarHBondContact O-N 3.27Å; P706-F708 VanDerWaalsContact C-N 3.27Å; P706-F708 PolarHBondContact O-N 2.86Å; F708-V712 HydrophobicContact CD1-CB 4.2Å; F708-V712 HydrophobicContact CD1-CG2 3.6Å; F708-V712 HydrophobicContact CE1-CG2 3.89Å
709	E	97.3	Very high	96.4	Very high	107 Å²	107	53.8 Å²	53.8	50%	0.5	30%	0.295	S	S	.	.			trans	-118	173	176.2	-65.9	178.4	139.6	0	0	109.8	Y664 K668 V707 D711 V712	Y664-E709 PolarHBondContact OH-N 3.11Å; Y664-E709 PolarHBondContact OH-O 2.87Å; K668-E709 IonicContact NZ-OE2 2.66Å; K668-E709 PolarHBondContact NZ-OE2 3.06Å; V707-E709 PolarHBondContact O-N 3.05Å; E709-D711 WeakPolarHBondContact CB-OD1 3.49Å; E709-D711 PolarHBondContact O-N 3.18Å; E709-D711 VanDerWaalsContact O-N 3.08Å; E709-V712 WeakPolarHBondContact O-CB 3.32Å; E709-V712 WeakPolarHBondContact O-CG1 3.24Å; E709-V712 PolarHBondContact O-N 3.24Å
710	G	96.9	Very high	96.3	Very high	50 Å²	50	50.7 Å²	50.7	52%	0.515	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-62.8	-16.9	-174.2	0	0	0	0	0	115.2	V712 Y713	G710-V712 PolarHBondContact O-N 3.3Å; G710-Y713 WeakPolarHBondContact O-CD2 3.43Å
711	D	96.8	Very high	96.2	Very high	57 Å²	57	48.6 Å²	48.6	31%	0.305	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-73.8	-9.6	174.8	65.7	-23.1	0	0	0	113.6	Y664 K668 E709 Y713 E714	Y664-D711 HydrophobicContact CE2-CB 4.49Å; Y664-D711 VanDerWaalsContact CE2-OD1 3.27Å; Y664-D711 WeakPolarHBondContact CE2-OD1 3.43Å; Y664-D711 PolarHBondContact OH-OD1 3.27Å; K668-D711 VanDerWaalsContact CE-OD2 3.32Å; K668-D711 WeakPolarHBondContact CE-OD2 3.44Å; K668-D711 VanDerWaalsContact NZ-CG 3.29Å; K668-D711 IonicContact NZ-OD1 2.81Å; K668-D711 PolarHBondContact NZ-OD1 2.77Å; K668-D711 VanDerWaalsContact NZ-OD1 3.12Å; K668-D711 IonicContact NZ-OD2 3.21Å; K668-D711 PolarHBondContact NZ-OD2 3.3Å; E709-D711 WeakPolarHBondContact CB-OD1 3.49Å; E709-D711 PolarHBondContact O-N 3.18Å; E709-D711 VanDerWaalsContact O-N 3.08Å; D711-Y713 PolarHBondContact O-N 3.45Å; D711-E714 WeakPolarHBondContact O-CB 3.45Å; D711-E714 PolarHBondContact O-N 3.22Å; D711-E714 VanDerWaalsContact O-N 3.14Å
712	V	97.2	Very high	96.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.4	-33.8	172.8	71.9	0	0	0	0	112.3	L661 Y664 L698 L701 F708 E709 G710 E714 Y715 L716	L661-V712 HydrophobicContact CD1-CG2 3.35Å; Y664-V712 HydrophobicContact CD1-CB 4.48Å; Y664-V712 HydrophobicContact CD1-CG2 4.02Å; Y664-V712 HydrophobicContact CE1-CB 3.99Å; Y664-V712 HydrophobicContact CE1-CG2 3.92Å; Y664-V712 VanDerWaalsContact CE2-CA 3.49Å; Y664-V712 HydrophobicContact CE2-CB 4.02Å; Y664-V712 HydrophobicContact CE2-CG2 4.49Å; Y664-V712 HydrophobicContact CG-CG2 4.35Å; L698-V712 HydrophobicContact CD1-CG1 4.48Å; L701-V712 HydrophobicContact CD1-CG1 3.66Å; L701-V712 HydrophobicContact CD1-CG2 4.34Å; F708-V712 HydrophobicContact CD1-CB 4.2Å; F708-V712 HydrophobicContact CD1-CG2 3.6Å; F708-V712 HydrophobicContact CE1-CG2 3.89Å; E709-V712 WeakPolarHBondContact O-CB 3.32Å; E709-V712 WeakPolarHBondContact O-CG1 3.24Å; E709-V712 PolarHBondContact O-N 3.24Å; G710-V712 PolarHBondContact O-N 3.3Å; V712-E714 PolarHBondContact O-N 3.27Å; V712-Y715 PolarHBondContact O-N 3.07Å; V712-L716 HydrophobicContact CG2-CD1 4.07Å; V712-L716 HydrophobicContact CG2-CG 4.47Å
713	Y	96.8	Very high	96.1	Very high	79 Å²	79	48.9 Å²	48.9	31%	0.31	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-69.1	-13.6	-179.1	-64.4	-70	0	0	0	113.5	L696 L698 L701 G710 D711 Y715 L716 N720	L696-Y713 WeakPolarHBondContact O-CE1 3.3Å; L696-Y713 PolarHBondContact O-OH 2.88Å; L698-Y713 HydrophobicContact CB-CE2 4.45Å; L698-Y713 PolarHBondContact N-OH 3.29Å; L701-Y713 HydrophobicContact CD1-CE1 4.45Å; G710-Y713 WeakPolarHBondContact O-CD2 3.43Å; D711-Y713 PolarHBondContact O-N 3.45Å; Y713-Y715 PolarHBondContact O-N 3.38Å; Y713-L716 HydrophobicContact CD1-CD1 4.23Å; Y713-L716 HydrophobicContact CE1-CD1 4.47Å; Y713-N720 PolarHBondContact O-ND2 3.15Å
714	E	96.3	Very high	96	Very high	101 Å²	101	47.3 Å²	47.3	47%	0.472	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-72	-14.5	168	-58.3	-173.8	-173.9	0	0	113.4	D711 V712 N720 K724	D711-E714 WeakPolarHBondContact O-CB 3.45Å; D711-E714 PolarHBondContact O-N 3.22Å; D711-E714 VanDerWaalsContact O-N 3.14Å; V712-E714 PolarHBondContact O-N 3.27Å; E714-N720 WeakPolarHBondContact O-CB 3.28Å; E714-K724 WeakPolarHBondContact O-CE 3.36Å; E714-K724 IonicContact OE2-NZ 2.68Å; E714-K724 PolarHBondContact OE2-NZ 3.38Å
715	Y	96	Very high	96	Very high	25 Å²	25	48.3 Å²	48.3	10%	0.098	26%	0.259	C	S	.	.	S	Bend	trans	-109.3	-5.9	-175.9	-70.5	-103.3	0	0	0	112.9	T660 Y664 K667 V712 Y713 K724	T660-Y715 WeakPolarHBondContact CB-O 3.47Å; T660-Y715 VanDerWaalsContact O-CD1 3.32Å; T660-Y715 WeakPolarHBondContact O-CD1 3.4Å; T660-Y715 PolarHBondContact OG1-O 2.66Å; Y664-Y715 AromaticContact CD2-CD2 3.59Å; Y664-Y715 HydrophobicContact CD2-CD2 3.59Å; Y664-Y715 AromaticContact CD2-CE2 3.79Å; Y664-Y715 HydrophobicContact CD2-CE2 3.79Å; Y664-Y715 HydrophobicContact CD2-CG 4.12Å; Y664-Y715 HydrophobicContact CE2-CD2 4.46Å; Y664-Y715 HydrophobicContact CG-CD2 4.32Å; Y664-Y715 HydrophobicContact CG-CG 4.42Å; K667-Y715 HydrophobicContact CD-CE1 4.05Å; K667-Y715 WeakPolarHBondContact CD-OH 3.38Å; K667-Y715 PolarHBondContact NZ-OH 3.12Å; V712-Y715 PolarHBondContact O-N 3.07Å; Y713-Y715 PolarHBondContact O-N 3.38Å; Y715-K724 HydrophobicContact CD1-CB 4.37Å; Y715-K724 HydrophobicContact CD1-CD 3.99Å; Y715-K724 HydrophobicContact CD1-CG 3.73Å; Y715-K724 HydrophobicContact CE1-CB 4.42Å; Y715-K724 HydrophobicContact CE1-CD 3.7Å; Y715-K724 HydrophobicContact CE1-CG 3.88Å; Y715-K724 HydrophobicContact CE2-CD 4.3Å; Y715-K724 HydrophobicContact CG-CD 4.41Å; Y715-K724 HydrophobicContact CG-CG 4.23Å
716	L	95.1	Very high	96	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	28%	0.277	C	S	.	.	S	Bend	trans	-107.8	147.4	-178.3	-65.2	177.9	0	0	0	110.9	D657 L661 L693 A694 L701 V712 Y713 N720	D657-L716 HydrophobicContact CB-CD2 4.39Å; D657-L716 WeakPolarHBondContact OD2-CA 3.18Å; L661-L716 HydrophobicContact CB-CD2 4.04Å; L661-L716 HydrophobicContact CD1-CD1 4.41Å; L661-L716 HydrophobicContact CD1-CD2 3.89Å; L661-L716 HydrophobicContact CD1-CG 4.28Å; L661-L716 HydrophobicContact CD2-CD2 4.19Å; L661-L716 HydrophobicContact CG-CD2 4.26Å; L693-L716 HydrophobicContact CB-CD2 3.71Å; L693-L716 HydrophobicContact CD1-CD2 4.49Å; A694-L716 HydrophobicContact CB-CB 4.02Å; L701-L716 HydrophobicContact CD1-CD1 4.35Å; V712-L716 HydrophobicContact CG2-CD1 4.07Å; V712-L716 HydrophobicContact CG2-CG 4.47Å; Y713-L716 HydrophobicContact CD1-CD1 4.23Å; Y713-L716 HydrophobicContact CE1-CD1 4.47Å; L716-N720 VanDerWaalsContact O-CB 3.27Å; L716-N720 WeakPolarHBondContact O-CB 3.48Å; L716-N720 PolarHBondContact O-ND2 2.74Å
717	G	93.3	Very high	95.9	Very high	19 Å²	19	50.2 Å²	50.2	20%	0.196	27%	0.27	C	S	.	.	S	Bend	trans	86.6	150.4	-165.3	0	0	0	0	0	112.3	D657 N720 A721	D657-G717 PolarHBondContact OD2-N 3.25Å; G717-N720 PolarHBondContact O-N 3.43Å; G717-A721 WeakPolarHBondContact O-CB 3.45Å; G717-A721 PolarHBondContact O-N 2.73Å
718	V	94.6	Very high	95.9	Very high	18 Å²	18	57.5 Å²	57.5	11%	0.109	30%	0.295	C	S	.	.	H	α-helix	trans	-75.7	-34.3	-167.4	-66.2	0	0	0	0	113.5	I441 P453 L651 L656 A721 V722	I441-V718 HydrophobicContact CD1-CG2 4.39Å; P453-V718 HydrophobicContact CB-CB 3.93Å; P453-V718 HydrophobicContact CB-CG1 4.14Å; P453-V718 HydrophobicContact CG-CB 4.28Å; P453-V718 HydrophobicContact CG-CG1 4.41Å; L651-V718 HydrophobicContact CB-CG1 4.37Å; L651-V718 HydrophobicContact CB-CG2 4.37Å; L651-V718 HydrophobicContact CD1-CG2 4Å; L656-V718 HydrophobicContact CB-CG1 4.08Å; L656-V718 HydrophobicContact CD1-CG1 4.08Å; V718-A721 PolarHBondContact O-N 3.26Å; V718-V722 WeakPolarHBondContact O-CG2 3.38Å; V718-V722 PolarHBondContact O-N 2.83Å
719	E	94.1	Very high	95.8	Very high	111 Å²	111	59.5 Å²	59.5	52%	0.519	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-43.4	173.6	-61.6	73.2	-165.3	0	0	110.7	I441 N723	I441-E719 HydrophobicContact CD1-CB 4.29Å; I441-E719 HydrophobicContact CD1-CG 3.92Å; E719-N723 WeakPolarHBondContact O-CB 3.09Å; E719-N723 PolarHBondContact O-N 3.13Å; E719-N723 VanDerWaalsContact O-N 3.09Å; E719-N723 PolarHBondContact O-ND2 3.31Å
720	N	95.1	Very high	95.8	Very high	65 Å²	65	55 Å²	55	35%	0.348	30%	0.296	S	S	.	.	H	α-helix	trans	-63.4	-48.2	174.4	-81.9	-17.9	0	0	0	111	Y713 E714 L716 G717 V722 N723 K724	Y713-N720 PolarHBondContact O-ND2 3.15Å; E714-N720 WeakPolarHBondContact O-CB 3.28Å; L716-N720 VanDerWaalsContact O-CB 3.27Å; L716-N720 WeakPolarHBondContact O-CB 3.48Å; L716-N720 PolarHBondContact O-ND2 2.74Å; G717-N720 PolarHBondContact O-N 3.43Å; N720-V722 PolarHBondContact O-N 2.85Å; N720-N723 CarbonylContact O-C 3.55Å; N720-N723 PolarHBondContact O-N 2.7Å; N720-N723 VanDerWaalsContact O-N 3.12Å; N720-K724 WeakPolarHBondContact O-CG 3.36Å; N720-K724 PolarHBondContact O-N 2.76Å
721	A	95.3	Very high	95.9	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.4	-47.8	177.9	0	0	0	0	0	112.2	P453 D657 T660 G717 V718 N723 K724 F725	P453-A721 HydrophobicContact CG-CB 3.65Å; D657-A721 HydrophobicContact CB-CB 4.25Å; T660-A721 HydrophobicContact CG2-CB 3.94Å; T660-A721 WeakPolarHBondContact OG1-CB 3.17Å; G717-A721 WeakPolarHBondContact O-CB 3.45Å; G717-A721 PolarHBondContact O-N 2.73Å; V718-A721 PolarHBondContact O-N 3.26Å; A721-N723 VanDerWaalsContact C-N 3.31Å; A721-N723 PolarHBondContact O-N 2.88Å; A721-K724 PolarHBondContact O-N 2.97Å; A721-K724 VanDerWaalsContact O-N 3.12Å; A721-F725 WeakPolarHBondContact O-CD2 3.36Å; A721-F725 WeakPolarHBondContact O-CE2 3.48Å
722	V	96.2	Very high	95.9	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-55.1	-46.3	173.8	166.3	0	0	0	0	111.3	I441 P453 L455 V718 N720 K724 F725 G732	I441-V722 HydrophobicContact CD1-CB 4.33Å; I441-V722 HydrophobicContact CD1-CG2 3.93Å; I441-V722 HydrophobicContact CG1-CG2 4.11Å; I441-V722 HydrophobicContact CG2-CG2 4.12Å; P453-V722 HydrophobicContact CB-CG2 3.97Å; P453-V722 HydrophobicContact CG-CG2 4.13Å; L455-V722 HydrophobicContact CD1-CG1 4.22Å; L455-V722 HydrophobicContact CD2-CG1 4.34Å; L455-V722 HydrophobicContact CG-CG1 3.91Å; V718-V722 WeakPolarHBondContact O-CG2 3.38Å; V718-V722 PolarHBondContact O-N 2.83Å; N720-V722 PolarHBondContact O-N 2.85Å; V722-K724 VanDerWaalsContact C-N 3.27Å; V722-K724 PolarHBondContact O-N 3.36Å; V722-F725 PolarHBondContact O-N 2.97Å; V722-G732 WeakPolarHBondContact O-CA 3.36Å
723	N	94.8	Very high	95.8	Very high	91 Å²	91	51.3 Å²	51.3	49%	0.487	27%	0.266	S	S	.	.	H	α-helix	trans	-72.7	-10.5	-179.3	-72	-47.7	0	0	0	114.8	E719 N720 A721 S733	E719-N723 WeakPolarHBondContact O-CB 3.09Å; E719-N723 PolarHBondContact O-N 3.13Å; E719-N723 VanDerWaalsContact O-N 3.09Å; E719-N723 PolarHBondContact O-ND2 3.31Å; N720-N723 CarbonylContact O-C 3.55Å; N720-N723 PolarHBondContact O-N 2.7Å; N720-N723 VanDerWaalsContact O-N 3.12Å; A721-N723 VanDerWaalsContact C-N 3.31Å; A721-N723 PolarHBondContact O-N 2.88Å; N723-S733 PolarHBondContact OD1-OG 3.15Å
724	K	95.8	Very high	95.7	Very high	53 Å²	53	53.6 Å²	53.6	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-88.6	-12.9	172.9	-64.5	-60.9	-177.3	-176.1	0	113.4	T660 E714 Y715 N720 A721 V722 I726	T660-K724 HydrophobicContact CG2-CB 4.22Å; E714-K724 WeakPolarHBondContact O-CE 3.36Å; E714-K724 IonicContact OE2-NZ 2.68Å; E714-K724 PolarHBondContact OE2-NZ 3.38Å; Y715-K724 HydrophobicContact CD1-CB 4.37Å; Y715-K724 HydrophobicContact CD1-CD 3.99Å; Y715-K724 HydrophobicContact CD1-CG 3.73Å; Y715-K724 HydrophobicContact CE1-CB 4.42Å; Y715-K724 HydrophobicContact CE1-CD 3.7Å; Y715-K724 HydrophobicContact CE1-CG 3.88Å; Y715-K724 HydrophobicContact CE2-CD 4.3Å; Y715-K724 HydrophobicContact CG-CD 4.41Å; Y715-K724 HydrophobicContact CG-CG 4.23Å; N720-K724 WeakPolarHBondContact O-CG 3.36Å; N720-K724 PolarHBondContact O-N 2.76Å; A721-K724 PolarHBondContact O-N 2.97Å; A721-K724 VanDerWaalsContact O-N 3.12Å; V722-K724 VanDerWaalsContact C-N 3.27Å; V722-K724 PolarHBondContact O-N 3.36Å; K724-I726 PolarHBondContact O-N 2.87Å
725	F	96.4	Very high	95.8	Very high	36 Å²	36	51.2 Å²	51.2	16%	0.158	27%	0.269	C	S	.	.			trans	-75.6	120	168.4	-63.6	-73.8	0	0	0	110.3	Q452 T660 A721 V722 T731 G732	Q452-F725 HydrophobicContact CB-CZ 4.46Å; Q452-F725 HydrophobicContact CG-CZ 4.49Å; T660-F725 HydrophobicContact CG2-CE2 4.47Å; T660-F725 HydrophobicContact CG2-CZ 4.37Å; A721-F725 WeakPolarHBondContact O-CD2 3.36Å; A721-F725 WeakPolarHBondContact O-CE2 3.48Å; V722-F725 PolarHBondContact O-N 2.97Å; F725-T731 HydrophobicContact CB-CG2 4.43Å; F725-T731 HydrophobicContact CD2-CG2 3.63Å; F725-T731 HydrophobicContact CE2-CG2 4.1Å; F725-T731 HydrophobicContact CG-CG2 4.14Å; F725-G732 WeakPolarHBondContact O-CA 3.46Å
726	I	95.6	Very high	95.9	Very high	126 Å²	126	50 Å²	50	65%	0.646	26%	0.264	S	S	*	.			trans	-132.2	-4.9	-172.7	61	170.3	0	0	0	114.7	K724 Q735	K724-I726 PolarHBondContact O-N 2.87Å; I726-Q735 PolarHBondContact O-NE2 2.8Å
727	S	96.4	Very high	96	Very high	75 Å²	75	54.1 Å²	54.1	52%	0.524	28%	0.282	S	S	.	.	S	Bend	trans	-71.8	153.9	179.2	47	0	0	0	0	112	G729 S730 Q735	S727-G729 PolarHBondContact O-N 3.25Å; S727-S730 PolarHBondContact N-OG 3.27Å; S727-S730 VanDerWaalsContact O-CB 3.29Å; S727-S730 WeakPolarHBondContact O-CB 3.2Å; S727-S730 PolarHBondContact O-N 2.95Å; S727-S730 VanDerWaalsContact O-N 3.12Å; S727-S730 PolarHBondContact O-OG 3.39Å; S727-S730 WeakPolarHBondContact OG-CB 3.21Å; S727-Q735 WeakPolarHBondContact O-CG 3.44Å
728	Y	96.5	Very high	96.1	Very high	189 Å²	189	58.6 Å²	58.6	74%	0.741	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	132.4	173.4	173.5	-97.9	0	0	0	111	S730	Y728-S730 VanDerWaalsContact C-N 3.28Å; Y728-S730 PolarHBondContact O-N 2.84Å
729	G	95.4	Very high	96.3	Very high	42 Å²	42	59.3 Å²	59.3	43%	0.433	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	21.4	-179.5	0	0	0	0	0	114.7	H458 S727	H458-G729 PolarHBondContact CE1-O 3.15Å; H458-G729 VanDerWaalsContact CE1-O 3.25Å; S727-G729 PolarHBondContact O-N 3.25Å
730	S	97.4	Very high	96.4	Very high	12 Å²	12	54.2 Å²	54.2	8%	0.084	27%	0.274	C	S	.	.	S	Bend	trans	-94.6	171	171.3	69.3	0	0	0	0	112.5	S727 Y728 G732 Q735	S727-S730 PolarHBondContact N-OG 3.27Å; S727-S730 VanDerWaalsContact O-CB 3.29Å; S727-S730 WeakPolarHBondContact O-CB 3.2Å; S727-S730 PolarHBondContact O-N 2.95Å; S727-S730 VanDerWaalsContact O-N 3.12Å; S727-S730 PolarHBondContact O-OG 3.39Å; S727-S730 WeakPolarHBondContact OG-CB 3.21Å; Y728-S730 VanDerWaalsContact C-N 3.28Å; Y728-S730 PolarHBondContact O-N 2.84Å; S730-G732 PolarHBondContact O-N 3.01Å; S730-Q735 WeakPolarHBondContact O-CB 3.34Å
731	T	97.9	Very high	96.5	Very high	8 Å²	8	55.2 Å²	55.2	5%	0.049	28%	0.277	C	S	.	.	S	Bend	trans	-77.6	0.4	-175.3	-156.3	0	0	0	0	115	V454 L455 H458 F725 V736	V454-T731 VanDerWaalsContact CA-OG1 3.31Å; V454-T731 WeakPolarHBondContact CA-OG1 3.48Å; V454-T731 HydrophobicContact CB-CG2 4.23Å; V454-T731 WeakPolarHBondContact CB-OG1 3.43Å; V454-T731 HydrophobicContact CG1-CG2 4.06Å; L455-T731 WeakPolarHBondContact CD1-O 3.32Å; L455-T731 PolarHBondContact N-OG1 3.32Å; H458-T731 VanDerWaalsContact CD2-CB 3.43Å; H458-T731 WeakPolarHBondContact CD2-CB 3.15Å; H458-T731 PolarHBondContact CD2-OG1 3.45Å; F725-T731 HydrophobicContact CB-CG2 4.43Å; F725-T731 HydrophobicContact CD2-CG2 3.63Å; F725-T731 HydrophobicContact CE2-CG2 4.1Å; F725-T731 HydrophobicContact CG-CG2 4.14Å; T731-V736 VanDerWaalsContact C-CG2 3.49Å; T731-V736 WeakPolarHBondContact O-CG2 3.35Å
732	G	96.9	Very high	96.6	Very high	2 Å²	2	58.9 Å²	58.9	2%	0.021	30%	0.296	C	S	.	.	S	Bend	trans	-64	142.5	-178.4	0	0	0	0	0	113.2	V722 F725 S730 E734 Q735 V736	V722-G732 WeakPolarHBondContact O-CA 3.36Å; F725-G732 WeakPolarHBondContact O-CA 3.46Å; S730-G732 PolarHBondContact O-N 3.01Å; G732-E734 VanDerWaalsContact C-N 3.32Å; G732-E734 PolarHBondContact O-N 3.14Å; G732-E734 VanDerWaalsContact O-N 3.12Å; G732-Q735 WeakPolarHBondContact O-CA 3.42Å; G732-Q735 WeakPolarHBondContact O-CB 3.45Å; G732-Q735 PolarHBondContact O-N 3.43Å; G732-V736 PolarHBondContact O-N 3.29Å
733	S	95.7	Very high	96.7	Very high	19 Å²	19	59.4 Å²	59.4	13%	0.133	30%	0.298	C	S	.	.	H	α-helix	trans	-47	-46.9	-170.4	-49.3	0	0	0	0	114.3	N723 K737	N723-S733 PolarHBondContact OD1-OG 3.15Å; S733-K737 WeakPolarHBondContact O-CB 3.48Å; S733-K737 WeakPolarHBondContact O-CD 3.11Å; S733-K737 WeakPolarHBondContact O-CG 3.26Å; S733-K737 PolarHBondContact O-N 2.92Å
734	E	95.9	Very high	96.8	Very high	127 Å²	127	57.7 Å²	57.7	59%	0.593	29%	0.285	S	S	*	.	H	α-helix	trans	-73.2	-32	179.9	-58.1	-49.4	115.3	0	0	113.6	G732 K737 K738	G732-E734 VanDerWaalsContact C-N 3.32Å; G732-E734 PolarHBondContact O-N 3.14Å; G732-E734 VanDerWaalsContact O-N 3.12Å; E734-K737 IonicContact OE1-NZ 3.17Å; E734-K737 PolarHBondContact OE1-NZ 3.05Å; E734-K737 IonicContact OE2-NZ 3.18Å; E734-K738 WeakPolarHBondContact O-CB 3.11Å; E734-K738 PolarHBondContact O-N 3.09Å
735	Q	97.5	Very high	96.9	Very high	51 Å²	51	60.1 Å²	60.1	24%	0.238	31%	0.305	C	S	.	.	H	α-helix	trans	-70.1	-41	175.6	-63.4	-70.2	-13.9	0	0	110.7	I726 S727 S730 G732 K738 Q739	I726-Q735 PolarHBondContact O-NE2 2.8Å; S727-Q735 WeakPolarHBondContact O-CG 3.44Å; S730-Q735 WeakPolarHBondContact O-CB 3.34Å; G732-Q735 WeakPolarHBondContact O-CA 3.42Å; G732-Q735 WeakPolarHBondContact O-CB 3.45Å; G732-Q735 PolarHBondContact O-N 3.43Å; Q735-K738 PolarHBondContact O-N 3.17Å; Q735-Q739 WeakPolarHBondContact O-CB 3.33Å; Q735-Q739 PolarHBondContact O-N 3.31Å
736	V	98.1	Very high	96.9	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-71.9	-41.2	179	175	0	0	0	0	111.7	L455 P457 H458 T731 G732 K738 Q739 L740	L455-V736 HydrophobicContact CB-CG1 4.34Å; L455-V736 HydrophobicContact CB-CG2 4.47Å; L455-V736 HydrophobicContact CD1-CB 3.97Å; L455-V736 HydrophobicContact CD1-CG1 4.05Å; L455-V736 HydrophobicContact CD1-CG2 4.1Å; P457-V736 HydrophobicContact CB-CG1 3.67Å; P457-V736 HydrophobicContact CG-CG1 4.48Å; H458-V736 HydrophobicContact CB-CG2 3.81Å; T731-V736 VanDerWaalsContact C-CG2 3.49Å; T731-V736 WeakPolarHBondContact O-CG2 3.35Å; G732-V736 PolarHBondContact O-N 3.29Å; V736-K738 VanDerWaalsContact C-N 3.33Å; V736-K738 PolarHBondContact O-N 3.27Å; V736-Q739 PolarHBondContact O-N 3.34Å; V736-L740 WeakPolarHBondContact O-CB 3.44Å; V736-L740 PolarHBondContact O-N 3.07Å
737	K	96.8	Very high	97	Very high	90 Å²	90	58 Å²	58	39%	0.391	29%	0.292	S	S	.	.	H	α-helix	trans	-56.7	-46.8	170	-75.7	167	-170.3	172.7	0	111.2	S733 E734 L740 E741	S733-K737 WeakPolarHBondContact O-CB 3.48Å; S733-K737 WeakPolarHBondContact O-CD 3.11Å; S733-K737 WeakPolarHBondContact O-CG 3.26Å; S733-K737 PolarHBondContact O-N 2.92Å; E734-K737 IonicContact OE1-NZ 3.17Å; E734-K737 PolarHBondContact OE1-NZ 3.05Å; E734-K737 IonicContact OE2-NZ 3.18Å; K737-L740 PolarHBondContact O-N 3.1Å; K737-E741 PolarHBondContact O-N 3.44Å; K737-E741 VanDerWaalsContact O-N 3.09Å
738	K	96.8	Very high	96.9	Very high	112 Å²	112	57.5 Å²	57.5	49%	0.487	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-50.5	177.2	-169.3	-167.3	170.9	-162.4	0	111.4	E734 Q735 V736 L740 E741 D742	E734-K738 WeakPolarHBondContact O-CB 3.11Å; E734-K738 PolarHBondContact O-N 3.09Å; Q735-K738 PolarHBondContact O-N 3.17Å; V736-K738 VanDerWaalsContact C-N 3.33Å; V736-K738 PolarHBondContact O-N 3.27Å; K738-L740 PolarHBondContact O-N 2.9Å; K738-E741 PolarHBondContact O-N 2.87Å; K738-D742 WeakPolarHBondContact CE-OD2 3.34Å; K738-D742 IonicContact NZ-OD2 2.89Å; K738-D742 WeakPolarHBondContact O-CB 3.46Å; K738-D742 PolarHBondContact O-N 2.83Å
739	Q	97.4	Very high	96.8	Very high	33 Å²	33	49.9 Å²	49.9	15%	0.154	27%	0.272	C	S	.	.	H	α-helix	trans	-57.7	-38.2	179.8	-160.3	-168.8	6.9	0	0	111.4	L461 E465 Q735 V736 W743	L461-Q739 HydrophobicContact CD1-CB 3.95Å; L461-Q739 HydrophobicContact CD1-CG 3.93Å; E465-Q739 PolarHBondContact OE1-NE2 3.11Å; Q735-Q739 WeakPolarHBondContact O-CB 3.33Å; Q735-Q739 PolarHBondContact O-N 3.31Å; V736-Q739 PolarHBondContact O-N 3.34Å; Q739-W743 WeakPolarHBondContact O-CB 3.46Å; Q739-W743 PolarHBondContact O-N 3.08Å
740	L	97.3	Very high	96.1	Very high	5 Å²	5	52.5 Å²	52.5	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-64.7	-40.8	176.1	-171	71.3	0	0	0	112.5	V431 A434 V438 L461 V736 K737 K738 W743 R744	V431-L740 HydrophobicContact CG1-CD1 3.99Å; A434-L740 HydrophobicContact CB-CD1 3.79Å; V438-L740 HydrophobicContact CG2-CD2 4.44Å; L461-L740 HydrophobicContact CD1-CB 4.32Å; L461-L740 HydrophobicContact CD1-CD1 4.38Å; L461-L740 HydrophobicContact CD2-CD1 4.31Å; V736-L740 WeakPolarHBondContact O-CB 3.44Å; V736-L740 PolarHBondContact O-N 3.07Å; K737-L740 PolarHBondContact O-N 3.1Å; K738-L740 PolarHBondContact O-N 2.9Å; L740-W743 PolarHBondContact O-N 2.9Å; L740-R744 VanDerWaalsContact O-CG 3.3Å; L740-R744 WeakPolarHBondContact O-CG 3.47Å; L740-R744 PolarHBondContact O-N 3.48Å
741	E	96.7	Very high	94.2	Very high	85 Å²	85	59.3 Å²	59.3	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-76.7	-37.5	-179.7	-161.8	60.8	-153.5	0	0	112.8	K737 K738 W743 R744 T745	K737-E741 PolarHBondContact O-N 3.44Å; K737-E741 VanDerWaalsContact O-N 3.09Å; K738-E741 PolarHBondContact O-N 2.87Å; E741-W743 VanDerWaalsContact C-N 3.3Å; E741-W743 PolarHBondContact O-N 3.28Å; E741-R744 PolarHBondContact O-N 2.63Å; E741-R744 WeakPolarHBondContact OE2-CD 3.18Å; E741-R744 IonicContact OE2-CZ 2.68Å; E741-R744 IonicContact OE2-NE 3.26Å; E741-R744 IonicContact OE2-NH1 2.64Å; E741-R744 PolarHBondContact OE2-NH1 3Å; E741-T745 WeakPolarHBondContact O-CB 3.5Å; E741-T745 PolarHBondContact O-N 2.9Å; E741-T745 PolarHBondContact O-OG1 2.92Å
742	D	97.3	Very high	94.1	Very high	77 Å²	77	61.9 Å²	61.9	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-56.4	-46.1	168.8	-69	-22	0	0	0	109.4	K738 T745 Q746	K738-D742 WeakPolarHBondContact CE-OD2 3.34Å; K738-D742 IonicContact NZ-OD2 2.89Å; K738-D742 WeakPolarHBondContact O-CB 3.46Å; K738-D742 PolarHBondContact O-N 2.83Å; D742-T745 PolarHBondContact O-N 2.74Å; D742-Q746 WeakPolarHBondContact O-CB 3.34Å; D742-Q746 PolarHBondContact O-N 3.38Å
743	W	98.2	Very high	93.9	Very high	13 Å²	13	65.1 Å²	65.1	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-68.7	-38.1	177.2	-86.3	116.1	0	0	0	114.4	V431 L461 V464 E465 E468 Q739 L740 E741 T745 Q746 L747	V431-W743 HydrophobicContact CG2-CB 4.01Å; L461-W743 HydrophobicContact CD2-CB 4.38Å; L461-W743 HydrophobicContact CD2-CG 4.18Å; V464-W743 HydrophobicContact CG1-CD2 3.51Å; V464-W743 HydrophobicContact CG1-CE3 3.54Å; V464-W743 HydrophobicContact CG1-CG 4.18Å; V464-W743 HydrophobicContact CG1-CH2 3.95Å; V464-W743 HydrophobicContact CG1-CZ2 3.91Å; V464-W743 HydrophobicContact CG1-CZ3 3.75Å; E465-W743 HydrophobicContact CG-CZ2 4.47Å; E465-W743 PolarHBondContact OE1-NE1 2.95Å; E465-W743 VanDerWaalsContact OE1-NE1 3.11Å; E468-W743 HydrophobicContact CB-CH2 3.71Å; E468-W743 HydrophobicContact CB-CZ2 4.47Å; E468-W743 HydrophobicContact CG-CH2 3.74Å; Q739-W743 WeakPolarHBondContact O-CB 3.46Å; Q739-W743 PolarHBondContact O-N 3.08Å; L740-W743 PolarHBondContact O-N 2.9Å; E741-W743 VanDerWaalsContact C-N 3.3Å; E741-W743 PolarHBondContact O-N 3.28Å; W743-T745 VanDerWaalsContact C-N 3.32Å; W743-Q746 HydrophobicContact CE3-CB 4.39Å; W743-Q746 HydrophobicContact CE3-CG 4.39Å; W743-Q746 HydrophobicContact CZ3-CG 4.16Å; W743-Q746 PolarHBondContact O-N 2.76Å; W743-L747 HydrophobicContact CE3-CD1 4.24Å; W743-L747 HydrophobicContact CE3-CG 4.18Å; W743-L747 WeakPolarHBondContact O-CB 3.32Å; W743-L747 VanDerWaalsContact O-CG 3.29Å; W743-L747 WeakPolarHBondContact O-CG 3.37Å; W743-L747 PolarHBondContact O-N 3.41Å
744	R	97.4	Very high	93.8	Very high	55 Å²	55	67.6 Å²	67.6	21%	0.208	38%	0.375	C	S	.	.	H	α-helix	trans	-59.1	-46.2	172.1	-76.5	163.3	175.5	-176.8	-5.4	111	V431 S435 L740 E741 L747 G748 I749	V431-R744 HydrophobicContact CG1-CG 3.86Å; S435-R744 PolarHBondContact OG-NE 2.82Å; S435-R744 PolarHBondContact OG-NH2 3.5Å; L740-R744 VanDerWaalsContact O-CG 3.3Å; L740-R744 WeakPolarHBondContact O-CG 3.47Å; L740-R744 PolarHBondContact O-N 3.48Å; E741-R744 PolarHBondContact O-N 2.63Å; E741-R744 WeakPolarHBondContact OE2-CD 3.18Å; E741-R744 IonicContact OE2-CZ 2.68Å; E741-R744 IonicContact OE2-NE 3.26Å; E741-R744 IonicContact OE2-NH1 2.64Å; E741-R744 PolarHBondContact OE2-NH1 3Å; R744-L747 PolarHBondContact O-N 3.39Å; R744-G748 PolarHBondContact O-N 3.1Å; R744-I749 HydrophobicContact CB-CB 4.23Å; R744-I749 HydrophobicContact CG-CB 4.25Å; R744-I749 HydrophobicContact CG-CG2 4.38Å; R744-I749 PolarHBondContact O-N 3.43Å
745	T	97.2	Very high	93.7	Very high	105 Å²	105	64.1 Å²	64.1	64%	0.644	36%	0.362	S	S	*	.	H	α-helix	trans	-60.6	-50.3	177.9	-56.3	0	0	0	0	111.1	E741 D742 W743 L747 G748	E741-T745 WeakPolarHBondContact O-CB 3.5Å; E741-T745 PolarHBondContact O-N 2.9Å; E741-T745 PolarHBondContact O-OG1 2.92Å; D742-T745 PolarHBondContact O-N 2.74Å; W743-T745 VanDerWaalsContact C-N 3.32Å; T745-L747 VanDerWaalsContact C-N 3.34Å; T745-L747 PolarHBondContact O-N 3.34Å; T745-G748 PolarHBondContact O-N 2.8Å
746	Q	96.5	Very high	93.4	Very high	106 Å²	106	64.9 Å²	64.9	50%	0.495	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-37.2	179.8	178.3	166.5	-19.7	0	0	113.1	E468 D742 W743	E468-Q746 VanDerWaalsContact CD-NE2 3.32Å; E468-Q746 PolarHBondContact OE1-NE2 3.49Å; D742-Q746 WeakPolarHBondContact O-CB 3.34Å; D742-Q746 PolarHBondContact O-N 3.38Å; W743-Q746 HydrophobicContact CE3-CB 4.39Å; W743-Q746 HydrophobicContact CE3-CG 4.39Å; W743-Q746 HydrophobicContact CZ3-CG 4.16Å; W743-Q746 PolarHBondContact O-N 2.76Å
747	L	97	Very high	93.1	Very high	10 Å²	10	69.2 Å²	69.2	5%	0.052	39%	0.394	C	S	.	.	H	α-helix	trans	-83.7	-18.2	-179.6	-65.1	170.2	0	0	0	113.1	K424 Q427 V428 V431 W743 R744 T745 I749	K424-L747 WeakPolarHBondContact CE-O 3.34Å; K424-L747 HydrophobicContact CG-CD2 4.03Å; K424-L747 PolarHBondContact NZ-O 3.41Å; Q427-L747 HydrophobicContact CB-CD1 4.01Å; Q427-L747 HydrophobicContact CB-CD2 3.95Å; V428-L747 HydrophobicContact CG2-CB 4.01Å; V428-L747 HydrophobicContact CG2-CD1 4.14Å; V428-L747 HydrophobicContact CG2-CD2 4.46Å; V428-L747 HydrophobicContact CG2-CG 4.44Å; V431-L747 HydrophobicContact CB-CD1 4.35Å; V431-L747 HydrophobicContact CG2-CD1 3.76Å; W743-L747 HydrophobicContact CE3-CD1 4.24Å; W743-L747 HydrophobicContact CE3-CG 4.18Å; W743-L747 WeakPolarHBondContact O-CB 3.32Å; W743-L747 VanDerWaalsContact O-CG 3.29Å; W743-L747 WeakPolarHBondContact O-CG 3.37Å; W743-L747 PolarHBondContact O-N 3.41Å; R744-L747 PolarHBondContact O-N 3.39Å; T745-L747 VanDerWaalsContact C-N 3.34Å; T745-L747 PolarHBondContact O-N 3.34Å; L747-I749 HydrophobicContact CB-CD1 4Å; L747-I749 HydrophobicContact CB-CG1 3.95Å; L747-I749 HydrophobicContact CD1-CD1 3.99Å
748	G	95.7	Very high	92.9	Very high	66 Å²	66	67.7 Å²	67.7	68%	0.68	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	32.1	-175.2	0	0	0	0	0	113.3	R744 T745	R744-G748 PolarHBondContact O-N 3.1Å; T745-G748 PolarHBondContact O-N 2.8Å
749	I	93.1	Very high	92.6	Very high	29 Å²	29	64.3 Å²	64.3	15%	0.149	39%	0.387	C	S	.	.			trans	-83.4	117.3	177.9	-58.8	170.4	0	0	0	108.3	V428 V431 L432 R744 L747	V428-I749 HydrophobicContact CB-CD1 4.28Å; V428-I749 HydrophobicContact CG1-CD1 4.05Å; V428-I749 HydrophobicContact CG1-CG1 4.18Å; V428-I749 HydrophobicContact CG2-CD1 4.08Å; V428-I749 HydrophobicContact CG2-CG1 4.11Å; V431-I749 HydrophobicContact CB-CD1 3.86Å; V431-I749 HydrophobicContact CG1-CD1 3.58Å; L432-I749 HydrophobicContact CD2-CG2 3.97Å; R744-I749 HydrophobicContact CB-CB 4.23Å; R744-I749 HydrophobicContact CG-CB 4.25Å; R744-I749 HydrophobicContact CG-CG2 4.38Å; R744-I749 PolarHBondContact O-N 3.43Å; L747-I749 HydrophobicContact CB-CD1 4Å; L747-I749 HydrophobicContact CB-CG1 3.95Å; L747-I749 HydrophobicContact CD1-CD1 3.99Å
750	S	80.3	Confident	92.2	Very high	96 Å²	96	66.9 Å²	66.9	67%	0.671	41%	0.406	S	S	*	.			trans	-66.5	139.9	170.6	53	0	0	0	0	111.3
751	S	59.2	Low	91.7	Very high	156 Å²	156	72.5 Å²	72.5	100%	1.091	44%	0.441	S	S	*	.			trans	-60.2	0	176.6	60.5	0	0	0	0	114.1

Retrieved 751 of 751 residues in 1667.3 ms (Link to these results)

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