A0A087XWN7_POEFO Loading...

Auxilin

AlphaFold DB , UniProt , Accession A0A087XWN7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 966 aa.

						>A0A087XWN7_POEFO|A0A087XWN7
MSLLGAYKKKTSYDGYECLQLVDSGGDSFGFGRGSSSGGGGGSIAATLGPKAGPLREEDCSTMDSSDAEMKDMDAGYGGGLLDMVKGGAGKFFSNFKDNLKDTLKDTSTKVMHQVATYTKGELDIAYITSRIIVMTYPAESVQIGYQNHVEDIRSFLDSRHADHYTVFNLSQRNYRGAKFSNRVSECNWPSRQAPSLHNLFAVCKNMHNWLKQNPKNVCVITCSDGRAPSGVLVCAMFCFCHLFSHPVPAMQLLSAKRPGSGLWPSHCRYIGYVCSMVSEKPTLPHSKPLVIKALTMSPIPCFNKQRSGCRPFCDVLIGETKIFTTAQEYERMREHRIQEGKVVFPLGVSVQGDVVVSVYHMRSTIGGRLQAKVSNTQIFQIQFHTGFIAPGTTMLKFNKPELDACDSPEKYPQLFHVILDVEVEGVDKQKDLTPPWEQFPCKDLSPSVLFSGHQEHQDALAIAGIQMLVFNPCYMFLSFSFPSLCRLNYPTEEPSRQHGEGRAHCEESEPSDDEMLSLSSQRSSISAASQKPEPAAPVPAAPAPTEEVDLLGLSGEDINRPCPSSQPAAAAATDLLGDLFGAPPQPASAPSSTQSTPHKVAPNSASPSPSPAPPAFHPFGTAPIPKPQEMMGSFLGPGNVGQPDPFVHAARSPSPTLQPTSLAPTVNIQQQNAMGGWDWNRPATTSTGGGFGIGSRSATTSPTGSVHSTPTHQTKPNTLDPFADIGNLCASGFSSKPTTPTGTTPSFPPMGSPSRPQPSPPSAGGGGGWQAQGQGPTAQPKPSPSHTSIPHTSPQNRPNYNVSFSAMGGGSPSAGVKPQAGTGCKPRASDANFDDLLSGQGFAGTKEKKGPRTIAEMRKEEMAKEMDPEKIKILDWIEGKERNIRALLSTMHTVLWEGETRWKPVGMADLVTPEQVKKVYRKAVLVVHPDKATGQPYEQYAKMIFMELNDAWSEFESQGQKPLYS
					

Structure Viewer

Loading PAE data...

(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	29.4	Very low	26.8	Very low	234 Å²	234	167.8 Å²	167.8	100%	1.153	89%	0.886	S	S	*	*				0	104.1	0	-61.5	173	-177.8	0	0	106
2	S	31.1	Very low	26.6	Very low	114 Å²	114	163.8 Å²	163.8	80%	0.797	88%	0.882	S	S	*	*				94.2	108.6	60.9	-67.1	0	0	0	0	111.4
3	L	28.8	Very low	26.4	Very low	175 Å²	175	167.2 Å²	167.2	92%	0.916	88%	0.876	S	S	*	*			trans	-169.8	114.8	131.3	-104.1	164.2	0	0	0	109.8
4	L	29.7	Very low	26.6	Very low	170 Å²	170	165.7 Å²	165.7	89%	0.89	87%	0.87	S	S	*	*			trans	-89.1	133.5	167.2	-77	93.6	0	0	0	109.5
5	G	27	Very low	26.4	Very low	75 Å²	75	159.3 Å²	159.3	77%	0.773	86%	0.859	S	S	*	*			trans	-94.9	100.5	168.1	0	0	0	0	0	111.2
6	A	26.5	Very low	26.3	Very low	101 Å²	101	163.6 Å²	163.6	84%	0.835	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-82.6	126.6	179.6	0	0	0	0	0	112.1
7	Y	25.9	Very low	26.1	Very low	235 Å²	235	165.5 Å²	165.5	92%	0.922	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-91.6	130.7	171.3	-88.8	-87.9	0	0	0	111.9
8	K	25.1	Very low	25.9	Very low	206 Å²	206	162.3 Å²	162.3	90%	0.896	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-93.6	116	-165.7	-153.8	172	-171.8	175.4	0	111	K10	K8-K10 PolarHBondContact O-N 3.16Å
9	K	23.3	Very low	25.9	Very low	203 Å²	203	163.4 Å²	163.4	88%	0.883	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-65.4	129.7	174.9	-162.8	176.3	-173.5	179.7	0	109.5
10	K	23.3	Very low	25.7	Very low	204 Å²	204	163.7 Å²	163.7	89%	0.887	86%	0.859	S	S	*	*			trans	-121	124.6	178.7	-157.1	179.7	-174.8	-173	0	109.7	K8	K8-K10 PolarHBondContact O-N 3.16Å
11	T	24.8	Very low	25.6	Very low	129 Å²	129	163.3 Å²	163.3	79%	0.791	86%	0.857	S	S	*	*			trans	-100.3	142.9	178.4	43.3	0	0	0	0	110.9
12	S	24.1	Very low	25.4	Very low	120 Å²	120	157.5 Å²	157.5	84%	0.839	83%	0.834	S	S	*	*			trans	-152.7	147.3	157.5	-154.1	0	0	0	0	108
13	Y	24.3	Very low	25.1	Very low	207 Å²	207	158.6 Å²	158.6	81%	0.812	83%	0.831	S	S	*	*			trans	-145.1	165.1	175.4	-151.8	-99.9	0	0	0	108.4
14	D	28.6	Very low	25.1	Very low	147 Å²	147	155.9 Å²	155.9	79%	0.786	83%	0.827	S	S	*	*			trans	62.6	150.2	-174.3	-53.5	-54	0	0	0	115.4
15	G	24.2	Very low	24.9	Very low	69 Å²	69	151.6 Å²	151.6	71%	0.711	82%	0.824	S	S	*	*			cis	-154.3	-178.8	0.4	0	0	0	0	0	112.8
16	Y	24.9	Very low	24.8	Very low	228 Å²	228	151.7 Å²	151.7	89%	0.894	83%	0.825	S	S	*	*			trans	-75.7	155.9	-174.5	-78.9	-107.5	0	0	0	114.3
17	E	23.5	Very low	24.8	Very low	197 Å²	197	154.3 Å²	154.3	92%	0.921	83%	0.825	S	S	*	*			trans	-147.7	160.9	135.4	-144.7	167.6	-146.9	0	0	111.4
18	C	22.8	Very low	24.8	Very low	107 Å²	107	148.1 Å²	148.1	72%	0.723	82%	0.816	S	S	*	*			trans	-105.1	160.2	-172	-66	0	0	0	0	113.1
19	L	24.4	Very low	24.8	Very low	183 Å²	183	148 Å²	148	96%	0.958	82%	0.816	S	S	*	*			trans	-125.1	134.6	155.5	-79.2	173.6	0	0	0	109.9
20	Q	22.7	Very low	25	Very low	170 Å²	170	141 Å²	141	79%	0.794	80%	0.801	S	S	*	*			trans	-143	160.3	-178.6	-177.7	179	4.7	0	0	108
21	L	23.6	Very low	25.1	Very low	156 Å²	156	141.5 Å²	141.5	82%	0.817	80%	0.803	S	S	*	*			trans	104.9	143.9	175	-60.4	163.3	0	0	0	114.8
22	V	24.1	Very low	25.1	Very low	112 Å²	112	138.7 Å²	138.7	68%	0.679	80%	0.801	S	S	*	*			cis	-166.5	159.3	-36.2	110.8	0	0	0	0	109.6
23	D	26.8	Very low	25.3	Very low	136 Å²	136	145.6 Å²	145.6	73%	0.727	81%	0.808	S	S	*	*			trans	22.3	137.6	166.8	-77.4	-76.1	0	0	0	123.4
24	S	27.3	Very low	25.3	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	80%	0.802	S	S	*	*				-178.3	132.4	97	-75	0	0	0	0	114.1
25	G	25.3	Very low	25.3	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	81%	0.807	S	S	*	*			trans	85.6	129.7	158.1	0	0	0	0	0	116.9
26	G	25.4	Very low	25.5	Very low	77 Å²	77	139.2 Å²	139.2	79%	0.794	81%	0.805	S	S	*	*			cis	133.8	114	-12.4	0	0	0	0	0	113.8
27	D	26.5	Very low	25.7	Very low	156 Å²	156	133.9 Å²	133.9	83%	0.834	80%	0.801	S	S	*	*			trans	-155.1	152.8	161.8	-120.4	-35.2	0	0	0	109.1
28	S	25.6	Very low	25.9	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	80%	0.799	S	S	*	*			trans	-159.9	124.4	-168	-73.5	0	0	0	0	116.8
29	F	26.3	Very low	26.1	Very low	204 Å²	204	127.3 Å²	127.3	90%	0.895	81%	0.805	S	S	*	*			trans	-153.4	140.6	156.6	-61.6	-77.7	0	0	0	107.3
30	G	26.6	Very low	26.2	Very low	55 Å²	55	122.9 Å²	122.9	57%	0.567	80%	0.803	S	S	*	*			cis	117.6	117.2	3.2	0	0	0	0	0	110.8
31	F	25.6	Very low	26.4	Very low	215 Å²	215	118.9 Å²	118.9	94%	0.943	81%	0.808	S	S	*	*			cis	-151.5	-179.4	2.3	-55.8	-85.6	0	0	0	108.4
32	G	25.4	Very low	26.6	Very low	71 Å²	71	115.4 Å²	115.4	73%	0.732	81%	0.81	S	S	*	*			cis	175.3	-154.2	7.6	0	0	0	0	0	113.3
33	R	26.7	Very low	26.9	Very low	264 Å²	264	115.6 Å²	115.6	100%	0.996	82%	0.816	S	S	*	*			trans	-19.8	149.7	174.1	-65.1	166.8	160.6	-174	-7.5	118.6
34	G	25.9	Very low	27	Very low	67 Å²	67	117.7 Å²	117.7	69%	0.691	83%	0.825	S	S	*	*			cis	147.6	170.7	-0.1	0	0	0	0	0	113.3
35	S	28.2	Very low	27.1	Very low	126 Å²	126	116.7 Å²	116.7	88%	0.881	82%	0.824	S	S	*	*			trans	69.9	153.2	172.3	-65.2	0	0	0	0	118
36	S	29.1	Very low	27.2	Very low	97 Å²	97	117.4 Å²	117.4	68%	0.678	82%	0.822	S	S	*	*			cis	-169.2	151.3	-16.1	48.5	0	0	0	0	114.1
37	S	28.9	Very low	27.4	Very low	115 Å²	115	119.8 Å²	119.8	80%	0.804	82%	0.821	S	S	*	*			trans	59.9	129.4	141.3	63.5	0	0	0	0	124.4
38	G	27.2	Very low	27.5	Very low	86 Å²	86	120.9 Å²	120.9	89%	0.887	83%	0.826	S	S	*	*			trans	106	142.5	146.2	0	0	0	0	0	117.2
39	G	26.6	Very low	27.5	Very low	81 Å²	81	118.9 Å²	118.9	84%	0.835	82%	0.822	S	S	*	*			cis	155.3	111.9	-13.3	0	0	0	0	0	115
40	G	27	Very low	28.7	Very low	89 Å²	89	115 Å²	115	92%	0.918	82%	0.817	S	S	*	*			trans	74.2	168	175.7	0	0	0	0	0	115.4
41	G	27.3	Very low	28.8	Very low	87 Å²	87	121.9 Å²	121.9	90%	0.897	83%	0.832	S	S	*	*			cis	143.7	117.3	-11.9	0	0	0	0	0	114.3
42	G	27.6	Very low	28.9	Very low	83 Å²	83	116.1 Å²	116.1	86%	0.856	82%	0.824	S	S	*	*			trans	134.1	151	165.6	0	0	0	0	0	117.7
43	S	29.3	Very low	28.9	Very low	116 Å²	116	116.1 Å²	116.1	81%	0.811	82%	0.824	S	S	*	*			trans	-81.2	174.8	166.6	-51.7	0	0	0	0	110.5
44	I	29.4	Very low	29.9	Very low	179 Å²	179	109 Å²	109	92%	0.918	81%	0.812	S	S	*	*				-166.4	-177	60.2	19.4	166.2	0	0	0	112.4
45	A	29.1	Very low	30.1	Very low	98 Å²	98	112.8 Å²	112.8	81%	0.81	82%	0.815	S	S	*	*			trans	-94.1	163.3	-159	0	0	0	0	0	119.5
46	A	28.1	Very low	30	Very low	95 Å²	95	116.3 Å²	116.3	79%	0.785	81%	0.809	S	S	*	*			trans	-159.1	133.1	145.2	0	0	0	0	0	107.5
47	T	29.5	Very low	29.9	Very low	128 Å²	128	118.7 Å²	118.7	79%	0.785	81%	0.81	S	S	*	*			cis	89.9	105	35.4	-57.4	0	0	0	0	114.2
48	L	28.7	Very low	29.8	Very low	178 Å²	178	121 Å²	121	93%	0.932	81%	0.807	S	S	*	*			trans	-177.9	152.9	139.3	-100.2	166.1	0	0	0	112.3
49	G	25.4	Very low	29.8	Very low	62 Å²	62	124.3 Å²	124.3	64%	0.639	81%	0.805	S	S	*	*			trans	-140.6	-147.1	172	0	0	0	0	0	109.5
50	P	51.2	Low	29.6	Very low	122 Å²	122	125.8 Å²	125.8	79%	0.792	80%	0.802	S	S	*	*			cis	-143.3	-155.6	-0.7	39.9	-17.2	0	0	0	114.4
51	K	27.5	Very low	29.6	Very low	201 Å²	201	126.5 Å²	126.5	87%	0.874	79%	0.792	S	S	*	*			trans	80.1	145.7	170.8	-65.7	-177	177	-177.5	0	117.6
52	A	28.8	Very low	29.7	Very low	94 Å²	94	127.9 Å²	127.9	78%	0.777	78%	0.784	S	S	*	*			cis	-162.6	163.1	-17	0	0	0	0	0	111
53	G	25.1	Very low	29.7	Very low	71 Å²	71	132 Å²	132	73%	0.732	78%	0.782	S	S	*	*			trans	-96.5	-148.8	168.7	0	0	0	0	0	112.7
54	P	47.7	Very low	29.5	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	78%	0.778	S	S	*	*			cis	-146.7	-169.6	8.3	43.7	-23.3	0	0	0	117.1
55	L	29.3	Very low	29.6	Very low	146 Å²	146	129 Å²	129	76%	0.764	77%	0.767	S	S	*	*			trans	72.3	156.9	162.9	-58.7	171.7	0	0	0	117.5
56	R	27	Very low	29.7	Very low	200 Å²	200	128.8 Å²	128.8	76%	0.755	76%	0.759	S	S	*	*			cis	-149.2	165	9.2	-157.2	179.2	165.1	108	5.2	112.5
57	E	26.3	Very low	29.7	Very low	147 Å²	147	131.3 Å²	131.3	69%	0.687	76%	0.76	S	S	*	*			trans	-82.2	159.9	171.9	-52.9	110	126.7	0	0	115.3
58	E	27.6	Very low	29.8	Very low	162 Å²	162	128.9 Å²	128.9	76%	0.757	75%	0.753	S	S	*	*				167.1	125.9	110.6	-89.9	176.3	175.2	0	0	115.2
59	D	26.1	Very low	29.8	Very low	157 Å²	157	128.7 Å²	128.7	84%	0.84	75%	0.747	S	S	*	*			trans	58.6	169.4	136.5	-72.3	12.4	0	0	0	127.7
60	C	23.8	Very low	29.8	Very low	112 Å²	112	133.1 Å²	133.1	76%	0.757	75%	0.753	S	S	*	*			trans	-63	171.7	-168.7	-54	0	0	0	0	115.7
61	S	27.6	Very low	28.7	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	75%	0.751	S	S	*	*			cis	-164.7	146.2	38.4	-37.9	0	0	0	0	110.6
62	T	28.4	Very low	28.7	Very low	117 Å²	117	130.9 Å²	130.9	72%	0.718	74%	0.736	S	S	*	*				70.8	113.4	92.3	-51	0	0	0	0	117.1
63	M	27.4	Very low	28.9	Very low	169 Å²	169	135 Å²	135	83%	0.833	74%	0.741	S	S	*	*			trans	65.7	159.1	162	-71	159.8	166	0	0	116.6
64	D	26.1	Very low	29.1	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	75%	0.745	S	S	*	*			cis	-145.4	173.4	5.4	-143.5	-26.1	0	0	0	113.7
65	S	30	Very low	28.4	Very low	97 Å²	97	137.9 Å²	137.9	68%	0.678	75%	0.746	S	S	*	*			trans	-25	151.1	174.5	-56.4	0	0	0	0	123.5
66	S	31.6	Very low	28.3	Very low	94 Å²	94	134 Å²	134	66%	0.657	74%	0.741	S	S	*	*				83.4	130.4	129.9	-88.3	0	0	0	0	124
67	D	29.4	Very low	28.5	Very low	148 Å²	148	136 Å²	136	79%	0.791	75%	0.751	S	S	*	*			trans	60.2	149.1	130.6	-56.5	-40.7	0	0	0	121
68	A	30.6	Very low	28.7	Very low	77 Å²	77	132.5 Å²	132.5	64%	0.636	75%	0.754	S	S	*	*			cis	-163.2	175.5	-17.9	0	0	0	0	0	109.8
69	E	28	Very low	28.8	Very low	174 Å²	174	129 Å²	129	81%	0.813	76%	0.761	S	S	*	*			trans	26.1	110.7	154.7	-69.2	-173.6	129.9	0	0	119.8
70	M	25.3	Very low	29	Very low	155 Å²	155	125 Å²	125	76%	0.764	76%	0.758	S	S	*	*				83.7	125.7	82.4	-178.9	-178	176.1	0	0	114.1
71	K	28.3	Very low	29.5	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	76%	0.762	S	S	*	*				174.8	139.1	129.8	-97.4	-172.6	170.7	-172.8	0	114.6
72	D	27.4	Very low	29.9	Very low	104 Å²	104	129.9 Å²	129.9	56%	0.556	77%	0.766	S	S	*	*				47.4	144.4	127.2	-48.1	-13.8	0	0	0	121.3
73	M	34.5	Very low	30.2	Very low	179 Å²	179	130.6 Å²	130.6	88%	0.882	77%	0.766	S	S	*	*			cis	-159.3	-178.7	-7.9	-115.2	172.7	83.6	0	0	111.1
74	D	29	Very low	30.7	Very low	153 Å²	153	130 Å²	130	82%	0.818	76%	0.763	S	S	*	*			trans	-85.1	149.2	-166.6	-166.2	-89.5	0	0	0	116.7
75	A	31.8	Very low	31.1	Very low	94 Å²	94	130.2 Å²	130.2	78%	0.777	77%	0.769	S	S	*	*			trans	165.1	137	143.7	0	0	0	0	0	110.4
76	G	28.9	Very low	31.5	Very low	64 Å²	64	135 Å²	135	66%	0.66	78%	0.777	S	S	*	*			cis	131.9	110.9	-9.3	0	0	0	0	0	113.2
77	Y	30.3	Very low	31.7	Very low	244 Å²	244	134.3 Å²	134.3	96%	0.957	79%	0.785	S	S	*	*			trans	-175.5	148.2	156.9	-128	-94.8	0	0	0	114.4
78	G	29.6	Very low	32.5	Very low	73 Å²	73	131 Å²	131	75%	0.753	79%	0.786	S	S	*	*			trans	80.8	116.1	146.4	0	0	0	0	0	121
79	G	30.5	Very low	33.2	Very low	87 Å²	87	132.4 Å²	132.4	90%	0.897	80%	0.798	S	S	*	*			trans	-99.4	-179.4	159.9	0	0	0	0	0	112.5
80	G	31.2	Very low	33.9	Very low	75 Å²	75	127.1 Å²	127.1	77%	0.773	79%	0.789	S	S	*	*			cis	170.1	-151.4	1.8	0	0	0	0	0	111.9
81	L	34.6	Very low	35	Very low	164 Å²	164	128.2 Å²	128.2	86%	0.859	79%	0.79	S	S	*	*			trans	81.2	122.9	171.5	-123.9	82.4	0	0	0	119.5
82	L	35	Very low	35.8	Very low	153 Å²	153	127.8 Å²	127.8	80%	0.801	79%	0.788	S	S	*	*			trans	63.2	141.8	160.4	-56.9	178.7	0	0	0	119.9
83	D	35.5	Very low	36.7	Very low	132 Å²	132	131.3 Å²	131.3	71%	0.706	80%	0.799	S	S	*	*			cis	-151.6	157.3	-26.1	-165.2	28	0	0	0	112.7
84	M	36.4	Very low	37.2	Very low	156 Å²	156	125.6 Å²	125.6	77%	0.768	78%	0.777	S	S	*	*			trans	-25	119.8	169.1	176.3	164.9	43.4	0	0	119.7
85	V	36.3	Very low	38.1	Very low	139 Å²	139	123.6 Å²	123.6	84%	0.842	77%	0.766	S	S	*	*			trans	-155.6	159.6	133.4	108.6	0	0	0	0	112.4
86	K	38.4	Very low	38.9	Very low	197 Å²	197	125.7 Å²	125.7	86%	0.857	76%	0.758	S	S	*	*			trans	74.5	57.2	169.8	-151.7	175.5	-173	176.2	0	118.2
87	G	35.7	Very low	40	Very low	80 Å²	80	129 Å²	129	83%	0.825	75%	0.754	S	S	*	*			trans	-76.2	174.6	150.6	0	0	0	0	0	112.4
88	G	45.7	Very low	41.1	Very low	79 Å²	79	120.4 Å²	120.4	81%	0.814	73%	0.725	S	S	*	*			trans	116.7	38.8	153.2	0	0	0	0	0	120.7
89	A	44.7	Very low	42.1	Very low	106 Å²	106	122.1 Å²	122.1	88%	0.876	72%	0.717	S	S	*	*	S	Bend	trans	-151.4	125	157.9	0	0	0	0	0	111.5
90	G	41.8	Very low	43.2	Very low	62 Å²	62	122 Å²	122	64%	0.639	70%	0.695	S	S	*	*	S	Bend	trans	144	-31.3	168.4	0	0	0	0	0	117.9	F92	G90-F92 PolarHBondContact O-N 3.12Å
91	K	49.7	Very low	44.3	Very low	178 Å²	178	124.8 Å²	124.8	77%	0.774	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	10	-171.4	-68.4	-170.4	176	-176.8	0	116.2	N95	K91-N95 PolarHBondContact O-ND2 3.15Å
92	F	45.2	Very low	45.2	Very low	164 Å²	164	121 Å²	121	72%	0.719	67%	0.666	S	S	*	*	H	α-helix	trans	-92.3	-24.6	-174.2	-70.5	-73.6	0	0	0	115.2	G90 F96	G90-F92 PolarHBondContact O-N 3.12Å; F92-F96 PolarHBondContact O-N 2.96Å
93	F	46.1	Very low	46.2	Very low	178 Å²	178	116.7 Å²	116.7	78%	0.781	65%	0.646	S	S	*	*	H	α-helix	trans	-89.6	-23.3	-173.9	-72.4	-73.7	0	0	0	115.3	K97	F93-K97 WeakPolarHBondContact O-CB 3.16Å; F93-K97 PolarHBondContact O-N 2.96Å
94	S	45.6	Very low	46.9	Very low	59 Å²	59	115.7 Å²	115.7	41%	0.413	64%	0.64	S	S	.	*	H	α-helix	trans	-70	-60.5	170.6	45.5	0	0	0	0	110.6	F96 K97 D98	S94-F96 PolarHBondContact O-N 3.4Å; S94-F96 VanDerWaalsContact O-N 3.13Å; S94-K97 PolarHBondContact O-N 3.48Å; S94-D98 PolarHBondContact O-N 3.47Å
95	N	46.7	Very low	47.6	Very low	111 Å²	111	113.3 Å²	113.3	59%	0.594	63%	0.626	S	S	*	*	H	α-helix	trans	-51.8	-40	-179.6	-70.9	-67.5	0	0	0	113.1	K91 N99	K91-N95 PolarHBondContact O-ND2 3.15Å; N95-N99 WeakPolarHBondContact O-CB 3.43Å; N95-N99 PolarHBondContact O-N 3.27Å
96	F	48.5	Very low	48.2	Very low	138 Å²	138	110.5 Å²	110.5	61%	0.605	61%	0.606	S	S	*	*	H	α-helix	trans	-69.6	-40.8	175.9	-172.6	-98.5	0	0	0	112.8	F92 S94 L100	F92-F96 PolarHBondContact O-N 2.96Å; S94-F96 PolarHBondContact O-N 3.4Å; S94-F96 VanDerWaalsContact O-N 3.13Å; F96-L100 HydrophobicContact CE1-CD2 4.19Å; F96-L100 WeakPolarHBondContact O-CB 3.48Å; F96-L100 PolarHBondContact O-N 2.98Å
97	K	51.8	Low	48.4	Very low	134 Å²	134	104.5 Å²	104.5	58%	0.583	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-42	177.8	-171.2	-168.1	69.6	177.8	0	111.5	F93 S94 L100 K101	F93-K97 WeakPolarHBondContact O-CB 3.16Å; F93-K97 PolarHBondContact O-N 2.96Å; S94-K97 PolarHBondContact O-N 3.48Å; K97-L100 PolarHBondContact O-N 3.2Å; K97-K101 WeakPolarHBondContact O-CB 3.43Å; K97-K101 PolarHBondContact O-N 2.62Å
98	D	54.2	Low	48.7	Very low	64 Å²	64	103.7 Å²	103.7	34%	0.342	57%	0.568	S	S	.	*	H	α-helix	trans	-75.3	-40.9	-177.9	-60	-43.9	0	0	0	110.5	S94 L100 K101 D102	S94-D98 PolarHBondContact O-N 3.47Å; D98-L100 VanDerWaalsContact C-N 3.35Å; D98-L100 PolarHBondContact O-N 3.38Å; D98-K101 PolarHBondContact O-N 2.86Å; D98-D102 WeakPolarHBondContact O-CB 3.49Å; D98-D102 PolarHBondContact O-N 3.18Å
99	N	51	Low	48.6	Very low	109 Å²	109	102.7 Å²	102.7	58%	0.583	55%	0.546	S	S	*	.	H	α-helix	trans	-66.4	-31.3	170.9	-171.3	-105.3	0	0	0	113.3	N95 T103	N95-N99 WeakPolarHBondContact O-CB 3.43Å; N95-N99 PolarHBondContact O-N 3.27Å; N99-T103 WeakPolarHBondContact O-CA 3.46Å; N99-T103 WeakPolarHBondContact O-CB 3.32Å; N99-T103 PolarHBondContact O-N 2.86Å; N99-T103 PolarHBondContact O-OG1 3.46Å
100	L	52.8	Low	48.5	Very low	83 Å²	83	103.1 Å²	103.1	44%	0.435	53%	0.528	S	S	.	.	H	α-helix	trans	-72.3	-39.7	171.8	178.6	62.1	0	0	0	111.9	F96 K97 D98 T103 L104	F96-L100 HydrophobicContact CE1-CD2 4.19Å; F96-L100 WeakPolarHBondContact O-CB 3.48Å; F96-L100 PolarHBondContact O-N 2.98Å; K97-L100 PolarHBondContact O-N 3.2Å; D98-L100 VanDerWaalsContact C-N 3.35Å; D98-L100 PolarHBondContact O-N 3.38Å; L100-T103 PolarHBondContact O-N 3.47Å; L100-L104 HydrophobicContact CD1-CD1 4.37Å; L100-L104 HydrophobicContact CG-CD1 4.27Å; L100-L104 WeakPolarHBondContact O-CB 3.33Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 3.22Å
101	K	53.9	Low	48.3	Very low	134 Å²	134	103.6 Å²	103.6	58%	0.583	52%	0.518	S	S	*	.	H	α-helix	trans	-63.4	-45.7	174.5	176.9	-169.9	174.9	-164.7	0	110.7	K97 D98 L104 K105	K97-K101 WeakPolarHBondContact O-CB 3.43Å; K97-K101 PolarHBondContact O-N 2.62Å; D98-K101 PolarHBondContact O-N 2.86Å; K101-L104 CarbonylContact O-C 3.59Å; K101-L104 PolarHBondContact O-N 3Å; K101-K105 WeakPolarHBondContact O-CB 3.32Å; K101-K105 PolarHBondContact O-N 3.17Å
102	D	54	Low	48.1	Very low	84 Å²	84	99.9 Å²	99.9	45%	0.449	51%	0.505	S	S	.	.	H	α-helix	trans	-73.4	-33.7	177.7	-68.7	-26.4	0	0	0	111.1	D98 L104 K105 D106	D98-D102 WeakPolarHBondContact O-CB 3.49Å; D98-D102 PolarHBondContact O-N 3.18Å; D102-L104 PolarHBondContact O-N 3.32Å; D102-K105 CarbonylContact O-C 3.58Å; D102-K105 PolarHBondContact O-N 3.11Å; D102-D106 VanDerWaalsContact O-CB 3.28Å; D102-D106 WeakPolarHBondContact O-CB 3.33Å; D102-D106 PolarHBondContact O-N 2.79Å
103	T	55.9	Low	47.9	Very low	63 Å²	63	97.6 Å²	97.6	39%	0.387	50%	0.496	S	S	.	.	H	α-helix	trans	-63.9	-38.5	168.3	-64.1	0	0	0	0	111.3	N99 L100 T107	N99-T103 WeakPolarHBondContact O-CA 3.46Å; N99-T103 WeakPolarHBondContact O-CB 3.32Å; N99-T103 PolarHBondContact O-N 2.86Å; N99-T103 PolarHBondContact O-OG1 3.46Å; L100-T103 PolarHBondContact O-N 3.47Å; T103-T107 WeakPolarHBondContact O-CA 3.42Å; T103-T107 WeakPolarHBondContact O-CB 3.22Å; T103-T107 PolarHBondContact O-N 2.9Å; T103-T107 PolarHBondContact O-OG1 2.88Å
104	L	49.8	Very low	47.5	Very low	111 Å²	111	95.7 Å²	95.7	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-70	-32.2	172.7	-79.4	166.1	0	0	0	112.4	L100 K101 D102 S108	L100-L104 HydrophobicContact CD1-CD1 4.37Å; L100-L104 HydrophobicContact CG-CD1 4.27Å; L100-L104 WeakPolarHBondContact O-CB 3.33Å; L100-L104 WeakPolarHBondContact O-CG 3.45Å; L100-L104 PolarHBondContact O-N 3.22Å; K101-L104 CarbonylContact O-C 3.59Å; K101-L104 PolarHBondContact O-N 3Å; D102-L104 PolarHBondContact O-N 3.32Å; L104-S108 WeakPolarHBondContact O-CB 2.94Å; L104-S108 PolarHBondContact O-N 3.17Å
105	K	52.2	Low	47.4	Very low	107 Å²	107	94 Å²	94	47%	0.465	48%	0.477	S	S	.	.	H	α-helix	trans	-71.4	-43.4	174.8	-153.7	-172.8	-177.1	-155.9	0	110.7	K101 D102 S108 T109	K101-K105 WeakPolarHBondContact O-CB 3.32Å; K101-K105 PolarHBondContact O-N 3.17Å; D102-K105 CarbonylContact O-C 3.58Å; D102-K105 PolarHBondContact O-N 3.11Å; K105-S108 WeakPolarHBondContact O-CB 3.25Å; K105-S108 PolarHBondContact O-N 2.76Å; K105-T109 WeakPolarHBondContact O-CB 3.38Å; K105-T109 PolarHBondContact O-N 3.45Å; K105-T109 PolarHBondContact O-OG1 3.03Å
106	D	48.5	Very low	47.1	Very low	80 Å²	80	90.3 Å²	90.3	43%	0.428	46%	0.461	S	S	.	.	H	α-helix	trans	-67.7	-41.4	173.7	-109.6	22.9	0	0	0	111.7	D102 S108 T109 K110	D102-D106 VanDerWaalsContact O-CB 3.28Å; D102-D106 WeakPolarHBondContact O-CB 3.33Å; D102-D106 PolarHBondContact O-N 2.79Å; D106-S108 VanDerWaalsContact C-N 3.32Å; D106-T109 PolarHBondContact O-N 3.22Å; D106-K110 HydrophobicContact CB-CD 4.36Å; D106-K110 WeakPolarHBondContact O-CA 3.19Å; D106-K110 WeakPolarHBondContact O-CB 3.39Å; D106-K110 WeakPolarHBondContact O-CD 3.17Å; D106-K110 WeakPolarHBondContact O-CG 3.33Å; D106-K110 PolarHBondContact O-N 2.85Å; D106-K110 WeakPolarHBondContact OD2-CE 3.3Å; D106-K110 IonicContact OD2-NZ 3.6Å; D106-K110 PolarHBondContact OD2-NZ 3.37Å
107	T	43.6	Very low	47	Very low	70 Å²	70	89 Å²	89	43%	0.429	47%	0.465	S	S	.	.	H	α-helix	trans	-65.2	-38.1	172	-66.9	0	0	0	0	109.8	T103 V111	T103-T107 WeakPolarHBondContact O-CA 3.42Å; T103-T107 WeakPolarHBondContact O-CB 3.22Å; T103-T107 PolarHBondContact O-N 2.9Å; T103-T107 PolarHBondContact O-OG1 2.88Å; T107-V111 HydrophobicContact CG2-CG2 3.97Å; T107-V111 WeakPolarHBondContact O-CA 3.43Å; T107-V111 WeakPolarHBondContact O-CB 3.45Å; T107-V111 WeakPolarHBondContact O-CG2 3.47Å; T107-V111 PolarHBondContact O-N 3.33Å
108	S	41.4	Very low	46.7	Very low	64 Å²	64	88.9 Å²	88.9	45%	0.448	46%	0.462	S	S	.	.	H	α-helix	trans	-62	-46.3	171.4	-170.3	0	0	0	0	111.5	L104 K105 D106 M112	L104-S108 WeakPolarHBondContact O-CB 2.94Å; L104-S108 PolarHBondContact O-N 3.17Å; K105-S108 WeakPolarHBondContact O-CB 3.25Å; K105-S108 PolarHBondContact O-N 2.76Å; D106-S108 VanDerWaalsContact C-N 3.32Å; S108-M112 VanDerWaalsContact O-CB 3.29Å; S108-M112 WeakPolarHBondContact O-CB 3.38Å; S108-M112 VanDerWaalsContact O-CG 3.22Å; S108-M112 WeakPolarHBondContact O-CG 3.29Å; S108-M112 PolarHBondContact O-N 2.77Å
109	T	43.9	Very low	46.3	Very low	57 Å²	57	92.3 Å²	92.3	35%	0.35	49%	0.485	S	S	.	.	H	α-helix	trans	-69.9	-38.3	179.9	-59.5	0	0	0	0	112.8	K105 D106 M112 H113	K105-T109 WeakPolarHBondContact O-CB 3.38Å; K105-T109 PolarHBondContact O-N 3.45Å; K105-T109 PolarHBondContact O-OG1 3.03Å; D106-T109 PolarHBondContact O-N 3.22Å; T109-M112 PolarHBondContact O-N 3.38Å; T109-H113 WeakPolarHBondContact O-CB 3.42Å; T109-H113 PolarHBondContact O-N 3.47Å; T109-H113 PolarHBondContact O-ND1 2.84Å
110	K	42.2	Very low	45.7	Very low	116 Å²	116	96.4 Å²	96.4	50%	0.504	50%	0.498	S	S	.	.	H	α-helix	trans	-73.6	-39.6	176.5	-71.5	161.3	177.8	161.6	0	110.9	D106 H113 Q114	D106-K110 HydrophobicContact CB-CD 4.36Å; D106-K110 WeakPolarHBondContact O-CA 3.19Å; D106-K110 WeakPolarHBondContact O-CB 3.39Å; D106-K110 WeakPolarHBondContact O-CD 3.17Å; D106-K110 WeakPolarHBondContact O-CG 3.33Å; D106-K110 PolarHBondContact O-N 2.85Å; D106-K110 WeakPolarHBondContact OD2-CE 3.3Å; D106-K110 IonicContact OD2-NZ 3.6Å; D106-K110 PolarHBondContact OD2-NZ 3.37Å; K110-H113 PolarHBondContact O-N 3.43Å; K110-Q114 WeakPolarHBondContact O-CB 3.34Å; K110-Q114 WeakPolarHBondContact O-CG 3.37Å; K110-Q114 PolarHBondContact O-N 3.3Å
111	V	38.2	Very low	45.5	Very low	71 Å²	71	94.9 Å²	94.9	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-39	168.9	171.4	0	0	0	0	110.3	T107 H113 Q114 V115	T107-V111 HydrophobicContact CG2-CG2 3.97Å; T107-V111 WeakPolarHBondContact O-CA 3.43Å; T107-V111 WeakPolarHBondContact O-CB 3.45Å; T107-V111 WeakPolarHBondContact O-CG2 3.47Å; T107-V111 PolarHBondContact O-N 3.33Å; V111-H113 PolarHBondContact O-N 3.15Å; V111-Q114 CarbonylContact O-C 3.53Å; V111-Q114 PolarHBondContact O-N 3.28Å; V111-V115 HydrophobicContact CG1-CG2 3.98Å; V111-V115 WeakPolarHBondContact O-CA 3.36Å; V111-V115 WeakPolarHBondContact O-CB 3.47Å; V111-V115 WeakPolarHBondContact O-CG2 3.46Å; V111-V115 PolarHBondContact O-N 3.4Å
112	M	44.8	Very low	45.9	Very low	101 Å²	101	94.2 Å²	94.2	50%	0.498	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-38	173.9	-76.8	-178.9	84	0	0	112.3	S108 T109 V115 A116	S108-M112 VanDerWaalsContact O-CB 3.29Å; S108-M112 WeakPolarHBondContact O-CB 3.38Å; S108-M112 VanDerWaalsContact O-CG 3.22Å; S108-M112 WeakPolarHBondContact O-CG 3.29Å; S108-M112 PolarHBondContact O-N 2.77Å; T109-M112 PolarHBondContact O-N 3.38Å; M112-V115 PolarHBondContact O-N 2.92Å; M112-A116 PolarHBondContact O-N 3.37Å
113	H	39.8	Very low	46.6	Very low	116 Å²	116	92.3 Å²	92.3	54%	0.537	49%	0.49	S	S	.	.	H	α-helix	trans	-73.8	-29.1	174	-77.2	85.5	0	0	0	113.5	T109 K110 V111 A116	T109-H113 WeakPolarHBondContact O-CB 3.42Å; T109-H113 PolarHBondContact O-N 3.47Å; T109-H113 PolarHBondContact O-ND1 2.84Å; K110-H113 PolarHBondContact O-N 3.43Å; V111-H113 PolarHBondContact O-N 3.15Å; H113-A116 WeakPolarHBondContact O-CB 3.33Å
114	Q	38	Very low	47.7	Very low	138 Å²	138	92 Å²	92	65%	0.645	49%	0.487	S	S	*	.	H	α-helix	trans	-76.3	-26.2	167.1	-70.4	-177.4	-84.4	0	0	112.4	K110 V111 A116 T117	K110-Q114 WeakPolarHBondContact O-CB 3.34Å; K110-Q114 WeakPolarHBondContact O-CG 3.37Å; K110-Q114 PolarHBondContact O-N 3.3Å; V111-Q114 CarbonylContact O-C 3.53Å; V111-Q114 PolarHBondContact O-N 3.28Å; Q114-A116 VanDerWaalsContact C-N 3.32Å; Q114-T117 CarbonylContact O-C 3.59Å; Q114-T117 PolarHBondContact O-N 2.91Å
115	V	43.6	Very low	49.4	Very low	24 Å²	24	87.5 Å²	87.5	15%	0.145	46%	0.463	C	S	.	.	H	α-helix	trans	-72.8	-26.3	173.2	162.8	0	0	0	0	111.7	V111 M112 T117 Y118	V111-V115 HydrophobicContact CG1-CG2 3.98Å; V111-V115 WeakPolarHBondContact O-CA 3.36Å; V111-V115 WeakPolarHBondContact O-CB 3.47Å; V111-V115 WeakPolarHBondContact O-CG2 3.46Å; V111-V115 PolarHBondContact O-N 3.4Å; M112-V115 PolarHBondContact O-N 2.92Å; V115-T117 PolarHBondContact O-N 3.14Å; V115-T117 VanDerWaalsContact O-N 3.16Å; V115-Y118 HydrophobicContact CB-CD2 4.35Å; V115-Y118 HydrophobicContact CB-CE2 4.47Å; V115-Y118 HydrophobicContact CG2-CD2 3.95Å; V115-Y118 HydrophobicContact CG2-CE2 3.6Å
116	A	41.6	Very low	51.2	Low	32 Å²	32	83 Å²	83	26%	0.264	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15	173.2	0	0	0	0	0	114	M112 H113 Q114	M112-A116 PolarHBondContact O-N 3.37Å; H113-A116 WeakPolarHBondContact O-CB 3.33Å; Q114-A116 VanDerWaalsContact C-N 3.32Å
117	T	45.8	Very low	53.3	Low	110 Å²	110	81 Å²	81	68%	0.675	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.9	74	173.3	-47.9	0	0	0	0	110	Q114 V115 T119	Q114-T117 CarbonylContact O-C 3.59Å; Q114-T117 PolarHBondContact O-N 2.91Å; V115-T117 PolarHBondContact O-N 3.14Å; V115-T117 VanDerWaalsContact O-N 3.16Å; T117-T119 PolarHBondContact O-N 2.81Å
118	Y	44.6	Very low	55.7	Low	133 Å²	133	77.9 Å²	77.9	52%	0.522	41%	0.413	S	S	.	.			trans	-76	115.5	-169.1	-138.3	-127.7	0	0	0	113.9	V115 K120 F156 R160	V115-Y118 HydrophobicContact CB-CD2 4.35Å; V115-Y118 HydrophobicContact CB-CE2 4.47Å; V115-Y118 HydrophobicContact CG2-CD2 3.95Å; V115-Y118 HydrophobicContact CG2-CE2 3.6Å; Y118-K120 PolarHBondContact O-N 3.41Å; Y118-F156 HydrophobicContact CD1-CE2 4.44Å; Y118-F156 HydrophobicContact CG-CE2 4.48Å; Y118-R160 VanDerWaalsContact CG-NH2 3.31Å
119	T	46	Very low	58.2	Low	136 Å²	136	75 Å²	75	83%	0.834	39%	0.393	S	S	*	.			trans	-76.8	85.7	-175.9	39.6	0	0	0	0	112.9	T117	T117-T119 PolarHBondContact O-N 2.81Å
120	K	40	Very low	60.7	Low	195 Å²	195	73.1 Å²	73.1	85%	0.848	38%	0.382	S	S	*	.	S	Bend	trans	-144.1	60	162.3	-160.5	-170.5	176.9	-169.7	0	111.2	Y118	Y118-K120 PolarHBondContact O-N 3.41Å
121	G	47.3	Very low	63.3	Low	50 Å²	50	68.1 Å²	68.1	52%	0.515	36%	0.36	S	S	.	.	S	Bend	trans	84.8	146.8	-163.8	0	0	0	0	0	111.1	L123	G121-L123 PolarHBondContact O-N 2.98Å
122	E	63.2	Low	66.1	Low	121 Å²	121	64.7 Å²	64.7	57%	0.565	34%	0.339	S	S	*	.			trans	-73.5	84.5	-171	-68.1	81.6	173.2	0	0	112.6	Y146	E122-Y146 HydrophobicContact CB-CD1 3.79Å; E122-Y146 HydrophobicContact CB-CG 4.22Å; E122-Y146 HydrophobicContact CG-CD1 3.63Å; E122-Y146 HydrophobicContact CG-CE1 3.97Å; E122-Y146 HydrophobicContact CG-CG 4.25Å; E122-Y146 VanDerWaalsContact OE1-CE1 3.26Å; E122-Y146 WeakPolarHBondContact OE1-CE1 3.38Å; E122-Y146 WeakPolarHBondContact OE2-CD1 3.22Å; E122-Y146 WeakPolarHBondContact OE2-CE1 3.34Å
123	L	68.9	Low	68.5	Low	43 Å²	43	59.9 Å²	59.9	23%	0.225	32%	0.316	C	S	.	.			trans	-89.2	120.2	166.6	-62.1	-178.3	0	0	0	111	G121 I125 N148 D152 I153 F156	G121-L123 PolarHBondContact O-N 2.98Å; L123-I125 VanDerWaalsContact C-N 3.33Å; L123-I125 HydrophobicContact CB-CD1 4.06Å; L123-I125 HydrophobicContact CB-CG1 4.12Å; L123-I125 HydrophobicContact CD1-CD1 4.06Å; L123-I125 PolarHBondContact O-N 3.28Å; L123-N148 VanDerWaalsContact CA-OD1 3.24Å; L123-N148 WeakPolarHBondContact CA-OD1 3.47Å; L123-D152 HydrophobicContact CD1-CB 4.22Å; L123-D152 HydrophobicContact CD2-CB 4.03Å; L123-I153 HydrophobicContact CD2-CG1 4.26Å; L123-F156 HydrophobicContact CD1-CB 4.26Å
124	D	79.1	Confident	71	Confident	58 Å²	58	54.5 Å²	54.5	31%	0.31	29%	0.291	S	S	.	.			trans	-76.6	86.1	168.1	177.2	21.5	0	0	0	109.9	M135 T136 N148 R258	D124-M135 VanDerWaalsContact O-CA 3.3Å; D124-M135 WeakPolarHBondContact O-CA 3.38Å; D124-M135 WeakPolarHBondContact O-CB 3.33Å; D124-T136 PolarHBondContact O-N 3.31Å; D124-T136 WeakPolarHBondContact OD2-CB 3.33Å; D124-T136 PolarHBondContact OD2-OG1 2.99Å; D124-N148 PolarHBondContact N-OD1 2.89Å; D124-N148 PolarHBondContact O-ND2 2.87Å; D124-N148 VanDerWaalsContact O-ND2 3.08Å; D124-R258 IonicContact OD1-CZ 3.61Å; D124-R258 IonicContact OD1-NH1 3.61Å; D124-R258 PolarHBondContact OD1-NH1 3.04Å; D124-R258 IonicContact OD1-NH2 2.67Å; D124-R258 PolarHBondContact OD1-NH2 3.24Å; D124-R258 VanDerWaalsContact OD1-NH2 3.09Å; D124-R258 IonicContact OD2-CZ 3.98Å; D124-R258 IonicContact OD2-NH1 2.72Å; D124-R258 IonicContact OD2-NH2 2.69Å; D124-R258 PolarHBondContact OD2-NH2 2.95Å
125	I	85.7	Confident	73.4	Confident	16 Å²	16	47.9 Å²	47.9	8%	0.082	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.6	173.1	-56.7	175.5	0	0	0	107.4	L123 I133 M135 I153 F156	L123-I125 VanDerWaalsContact C-N 3.33Å; L123-I125 HydrophobicContact CB-CD1 4.06Å; L123-I125 HydrophobicContact CB-CG1 4.12Å; L123-I125 HydrophobicContact CD1-CD1 4.06Å; L123-I125 PolarHBondContact O-N 3.28Å; I125-I133 HydrophobicContact CG2-CG2 3.4Å; I125-M135 HydrophobicContact CG1-CB 4.04Å; I125-I153 HydrophobicContact CD1-CG1 4.26Å; I125-F156 HydrophobicContact CD1-CB 4.5Å; I125-F156 HydrophobicContact CD1-CD1 3.6Å; I125-F156 HydrophobicContact CD1-CE1 3.92Å; I125-F156 HydrophobicContact CD1-CG 4.03Å; I125-F156 HydrophobicContact CG2-CE1 4.12Å
126	A	88.6	Confident	75.3	Confident	13 Å²	13	48.2 Å²	48.2	11%	0.107	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.6	177.7	0	0	0	0	0	111.2	I128 I133 V134	A126-I128 HydrophobicContact CB-CD1 4.41Å; A126-I133 CarbonylContact O-C 3.48Å; A126-I133 WeakPolarHBondContact O-CA 3.47Å; A126-V134 PolarHBondContact N-O 3.09Å; A126-V134 PolarHBondContact O-N 3.08Å
127	Y	92.8	Very high	77	Confident	37 Å²	37	48.3 Å²	48.3	15%	0.145	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.7	169.4	-73.8	-108	0	0	0	108.8	I133 F156 R160 H161	Y127-I133 HydrophobicContact CD1-CD1 4.13Å; Y127-I133 HydrophobicContact CD1-CG1 3.71Å; Y127-I133 HydrophobicContact CE1-CD1 3.55Å; Y127-I133 HydrophobicContact CE1-CG1 3.68Å; Y127-I133 HydrophobicContact CE2-CD1 4.39Å; Y127-I133 HydrophobicContact CE2-CG1 4.46Å; Y127-I133 HydrophobicContact CG-CG1 4.16Å; Y127-F156 HydrophobicContact CE2-CE1 4.19Å; Y127-F156 HydrophobicContact CE2-CZ 4.03Å; Y127-R160 WeakPolarHBondContact OH-CD 3.47Å; Y127-H161 AromaticContact CE1-NE2 3.76Å; Y127-H161 AromaticContact CZ-NE2 3.85Å; Y127-H161 PolarHBondContact OH-NE2 2.93Å; Y127-H161 VanDerWaalsContact OH-NE2 3.13Å
128	I	94	Very high	78.1	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-41.2	173.1	-44	-57	0	0	0	109	A126 I132 V134 V234 F238 L254 K257 R258	A126-I128 HydrophobicContact CB-CD1 4.41Å; I128-I132 PolarHBondContact N-O 3.25Å; I128-V134 HydrophobicContact CD1-CB 4.44Å; I128-V134 HydrophobicContact CD1-CG2 4.16Å; I128-V134 HydrophobicContact CG1-CB 4.4Å; I128-V134 HydrophobicContact CG1-CG2 3.7Å; I128-V234 HydrophobicContact CG2-CG1 4.06Å; I128-F238 HydrophobicContact CG2-CE2 4.25Å; I128-F238 HydrophobicContact CG2-CZ 3.76Å; I128-L254 HydrophobicContact CD1-CD1 4.3Å; I128-K257 HydrophobicContact CD1-CB 4.08Å; I128-K257 HydrophobicContact CG2-CB 3.99Å; I128-K257 HydrophobicContact CG2-CG 4.15Å; I128-R258 HydrophobicContact CD1-CB 3.84Å
129	T	95.3	Very high	78.9	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	171.1	159	74.9	0	0	0	0	108.5	R131 I132 F238 L450 F451 E456	T129-R131 PolarHBondContact O-N 2.96Å; T129-R131 VanDerWaalsContact O-N 3.13Å; T129-R131 PolarHBondContact OG1-N 2.75Å; T129-I132 PolarHBondContact N-O 2.82Å; T129-I132 PolarHBondContact O-N 2.87Å; T129-I132 VanDerWaalsContact O-O 3.07Å; T129-I132 PolarHBondContact OG1-N 3.1Å; T129-F238 HydrophobicContact CG2-CE1 4.11Å; T129-F238 HydrophobicContact CG2-CZ 4.3Å; T129-L450 VanDerWaalsContact CB-O 3.27Å; T129-L450 WeakPolarHBondContact CB-O 3.4Å; T129-L450 PolarHBondContact OG1-O 3.4Å; T129-F451 HydrophobicContact CG2-CD1 3.9Å; T129-F451 HydrophobicContact CG2-CE1 3.6Å; T129-F451 HydrophobicContact CG2-CZ 4.42Å; T129-E456 WeakPolarHBondContact CA-OE1 3.48Å; T129-E456 WeakPolarHBondContact CB-OE1 3.41Å
130	S	94.9	Very high	79.4	Confident	16 Å²	16	35.9 Å²	35.9	11%	0.112	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-24.1	171.8	58.6	0	0	0	0	113.5	S452 E456	S130-S452 WeakPolarHBondContact CB-OG 3.41Å; S130-S452 VanDerWaalsContact OG-CB 3.29Å; S130-S452 WeakPolarHBondContact OG-CB 3.21Å; S130-S452 PolarHBondContact OG-N 3.43Å; S130-S452 PolarHBondContact OG-OG 3.36Å; S130-E456 WeakPolarHBondContact CB-OE1 3.22Å; S130-E456 WeakPolarHBondContact CB-OE2 3.28Å; S130-E456 PolarHBondContact N-OE1 2.97Å; S130-E456 VanDerWaalsContact OG-CD 3.24Å; S130-E456 PolarHBondContact OG-OE1 3.27Å; S130-E456 VanDerWaalsContact OG-OE1 3.1Å; S130-E456 PolarHBondContact OG-OE2 3.09Å
131	R	97.2	Very high	79.6	Confident	11 Å²	11	30 Å²	30	4%	0.042	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-7.9	-178.6	-49.5	-170.1	65.6	-166.7	3.6	114.8	T129 L211 N214 P215 N217 V218 C219 V449 F451 S452	T129-R131 PolarHBondContact O-N 2.96Å; T129-R131 VanDerWaalsContact O-N 3.13Å; T129-R131 PolarHBondContact OG1-N 2.75Å; R131-L211 HydrophobicContact CB-CD2 4.15Å; R131-L211 PolarHBondContact NH1-O 3.03Å; R131-L211 PolarHBondContact NH2-O 3.17Å; R131-N214 PolarHBondContact NH2-O 3.06Å; R131-P215 VanDerWaalsContact CZ-O 3.29Å; R131-P215 PolarHBondContact NE-O 2.65Å; R131-P215 PolarHBondContact NH2-O 3.48Å; R131-N217 VanDerWaalsContact CZ-O 3.29Å; R131-N217 PolarHBondContact NE-O 2.59Å; R131-N217 PolarHBondContact NH2-O 3.1Å; R131-V218 HydrophobicContact CB-CG1 4.48Å; R131-V218 WeakPolarHBondContact O-CA 3.4Å; R131-C219 PolarHBondContact O-N 2.78Å; R131-V449 PolarHBondContact NH1-O 3.14Å; R131-F451 WeakPolarHBondContact CD-O 3.3Å; R131-S452 WeakPolarHBondContact CG-OG 3.36Å
132	I	97.4	Very high	79.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	108.8	176.4	-63	-175.9	0	0	0	109.9	I128 T129 M207 I221 V234 M237 F238 L450	I128-I132 PolarHBondContact N-O 3.25Å; T129-I132 PolarHBondContact N-O 2.82Å; T129-I132 PolarHBondContact O-N 2.87Å; T129-I132 VanDerWaalsContact O-O 3.07Å; T129-I132 PolarHBondContact OG1-N 3.1Å; I132-M207 HydrophobicContact CD1-CE 4.3Å; I132-I221 HydrophobicContact CG2-CD1 3.96Å; I132-V234 HydrophobicContact CG2-CG2 4.14Å; I132-M237 HydrophobicContact CD1-CG 3.9Å; I132-F238 HydrophobicContact CD1-CE1 4.31Å; I132-L450 HydrophobicContact CD1-CD2 3.7Å
133	I	95.1	Very high	78.6	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	138.4	-178.4	-59.3	170.3	0	0	0	108.5	I125 A126 Y127 L157 H161 V218 C219 V220 I221	I125-I133 HydrophobicContact CG2-CG2 3.4Å; A126-I133 CarbonylContact O-C 3.48Å; A126-I133 WeakPolarHBondContact O-CA 3.47Å; Y127-I133 HydrophobicContact CD1-CD1 4.13Å; Y127-I133 HydrophobicContact CD1-CG1 3.71Å; Y127-I133 HydrophobicContact CE1-CD1 3.55Å; Y127-I133 HydrophobicContact CE1-CG1 3.68Å; Y127-I133 HydrophobicContact CE2-CD1 4.39Å; Y127-I133 HydrophobicContact CE2-CG1 4.46Å; Y127-I133 HydrophobicContact CG-CG1 4.16Å; I133-L157 HydrophobicContact CD1-CD2 4.44Å; I133-H161 WeakPolarHBondContact CD1-NE2 3.43Å; I133-V218 HydrophobicContact CD1-CB 4.46Å; I133-V218 HydrophobicContact CD1-CG2 4.09Å; I133-C219 PolarHBondContact N-O 2.77Å; I133-V220 HydrophobicContact CB-CG2 4.26Å; I133-V220 HydrophobicContact CD1-CG2 4.16Å; I133-V220 HydrophobicContact CG2-CG1 4.45Å; I133-I221 PolarHBondContact O-N 2.69Å
134	V	92.8	Very high	77.2	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	131.8	173.2	176.6	0	0	0	0	109.3	A126 I128 I221 V234	A126-V134 PolarHBondContact N-O 3.09Å; A126-V134 PolarHBondContact O-N 3.08Å; I128-V134 HydrophobicContact CD1-CB 4.44Å; I128-V134 HydrophobicContact CD1-CG2 4.16Å; I128-V134 HydrophobicContact CG1-CB 4.4Å; I128-V134 HydrophobicContact CG1-CG2 3.7Å; V134-I221 WeakPolarHBondContact CA-O 3.38Å; V134-I221 HydrophobicContact CG2-CB 4.38Å; V134-V234 HydrophobicContact CG2-CG2 3.73Å
135	M	88.7	Confident	75.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	144.8	178.2	69.1	-172	-166.1	0	0	112.4	D124 I125 I153 V167 F180 V220 I221 T222	D124-M135 VanDerWaalsContact O-CA 3.3Å; D124-M135 WeakPolarHBondContact O-CA 3.38Å; D124-M135 WeakPolarHBondContact O-CB 3.33Å; I125-M135 HydrophobicContact CG1-CB 4.04Å; M135-I153 HydrophobicContact CE-CD1 4.41Å; M135-I153 HydrophobicContact CE-CG2 4.12Å; M135-I153 HydrophobicContact SD-CD1 3.81Å; M135-I153 HydrophobicContact SD-CG2 3.64Å; M135-V167 HydrophobicContact CE-CG1 3.96Å; M135-F180 HydrophobicContact CE-CZ 4.47Å; M135-V220 HydrophobicContact CE-CG1 3.71Å; M135-V220 HydrophobicContact CG-CG1 4.1Å; M135-V220 HydrophobicContact SD-CG1 3.39Å; M135-V220 WeakPolarHBondContact SD-CG1 3.26Å; M135-I221 PolarHBondContact N-O 2.8Å; M135-T222 HydrophobicContact CE-CG2 3.98Å; M135-T222 VanDerWaalsContact O-CA 3.27Å; M135-T222 WeakPolarHBondContact O-CA 3.47Å; M135-T222 WeakPolarHBondContact O-CB 3.26Å; M135-T222 PolarHBondContact O-OG1 2.67Å
136	T	83.4	Confident	74.2	Confident	30 Å²	30	47.5 Å²	47.5	18%	0.184	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.8	171.9	-70.8	0	0	0	0	110.9	D124 N148 D225 G226	D124-T136 PolarHBondContact O-N 3.31Å; D124-T136 WeakPolarHBondContact OD2-CB 3.33Å; D124-T136 PolarHBondContact OD2-OG1 2.99Å; T136-N148 PolarHBondContact O-ND2 3.07Å; T136-D225 VanDerWaalsContact OG1-C 3.28Å; T136-D225 PolarHBondContact OG1-O 3.1Å; T136-G226 WeakPolarHBondContact OG1-CA 3.36Å; T136-G226 PolarHBondContact OG1-N 3.03Å
137	Y	77.4	Confident	72.8	Confident	35 Å²	35	50.5 Å²	50.5	14%	0.137	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-55.6	125.4	-179.4	-172.4	-82.3	0	0	0	111.4	S171 R173 Y175 T222 C223	Y137-S171 WeakPolarHBondContact CD2-OG 3.11Å; Y137-R173 HydrophobicContact CE1-CB 4.31Å; Y137-R173 HydrophobicContact CE2-CB 3.97Å; Y137-R173 WeakPolarHBondContact CE2-O 3.35Å; Y137-R173 PolarHBondContact OH-O 3.15Å; Y137-Y175 HydrophobicContact CD2-CE2 4.25Å; Y137-Y175 HydrophobicContact CE2-CD2 4.27Å; Y137-Y175 HydrophobicContact CE2-CE1 4.26Å; Y137-Y175 AromaticContact CE2-CE2 3.71Å; Y137-Y175 HydrophobicContact CE2-CE2 3.71Å; Y137-Y175 AromaticContact CE2-CZ 3.72Å; Y137-T222 WeakPolarHBondContact CA-OG1 3.47Å; Y137-T222 PolarHBondContact N-OG1 2.97Å; Y137-C223 WeakPolarHBondContact CB-O 3.4Å; Y137-C223 PolarHBondContact N-O 3.02Å
138	P	68.1	Low	71.6	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-73.8	146.6	-174.5	30.6	-35	0	0	0	113.1	N148 V150 I153 Y175	P138-N148 CarbonylContact C-O 3.56Å; P138-N148 WeakPolarHBondContact CA-O 3.47Å; P138-N148 HydrophobicContact CB-CB 3.9Å; P138-N148 WeakPolarHBondContact CB-O 3.27Å; P138-V150 HydrophobicContact CB-CB 4.41Å; P138-V150 HydrophobicContact CB-CG2 3.89Å; P138-V150 HydrophobicContact CG-CB 4.35Å; P138-V150 HydrophobicContact CG-CG1 4.21Å; P138-V150 HydrophobicContact CG-CG2 3.86Å; P138-I153 HydrophobicContact CB-CD1 4.09Å; P138-I153 HydrophobicContact CG-CD1 4.39Å; P138-Y175 WeakPolarHBondContact CD-OH 3.44Å; P138-Y175 HydrophobicContact CG-CE1 3.67Å
139	A	61.4	Low	70.7	Confident	21 Å²	21	51.7 Å²	51.7	17%	0.174	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-78.5	130.5	179.3	0	0	0	0	0	111.2	S141 Q147 N148	A139-S141 VanDerWaalsContact C-N 3.26Å; A139-S141 PolarHBondContact O-N 2.81Å; A139-Q147 HydrophobicContact CB-CB 4.32Å; A139-N148 PolarHBondContact N-O 3.05Å
140	E	55.3	Low	70	Confident	95 Å²	95	51.6 Å²	51.6	44%	0.444	28%	0.275	S	S	.	.	S	Bend	trans	-83.5	0.4	176.6	-174.2	158.1	-108.4	0	0	113.3	R176 K179	E140-R176 WeakPolarHBondContact OE1-CD 3.33Å; E140-R176 IonicContact OE1-CZ 2.89Å; E140-R176 IonicContact OE1-NE 2.7Å; E140-R176 PolarHBondContact OE1-NE 2.92Å; E140-R176 IonicContact OE2-CZ 3.3Å; E140-R176 IonicContact OE2-NE 2.65Å; E140-R176 PolarHBondContact OE2-NE 3.15Å; E140-R176 IonicContact OE2-NH2 2.66Å; E140-R176 PolarHBondContact OE2-NH2 2.89Å; E140-K179 VanDerWaalsContact OE1-CE 3.31Å; E140-K179 WeakPolarHBondContact OE1-CE 3.4Å; E140-K179 IonicContact OE1-NZ 3.15Å; E140-K179 PolarHBondContact OE1-NZ 3.45Å
141	S	45.7	Very low	69.4	Low	73 Å²	73	56.1 Å²	56.1	51%	0.51	29%	0.294	S	S	.	.	S	Bend	trans	-139.5	140.4	178.5	60.7	0	0	0	0	110.2	A139 Q143	A139-S141 VanDerWaalsContact C-N 3.26Å; A139-S141 PolarHBondContact O-N 2.81Å; S141-Q143 PolarHBondContact O-N 3.27Å
142	V	44.7	Very low	68.8	Low	119 Å²	119	59.7 Å²	59.7	72%	0.721	31%	0.314	S	S	*	.			trans	-67	90.3	175.9	-174.1	0	0	0	0	110.5
143	Q	44	Very low	68.2	Low	116 Å²	116	59.7 Å²	59.7	54%	0.542	31%	0.314	S	S	.	.			trans	-82	135.9	155.3	-65.6	-172	-21.1	0	0	107.6	S141 G145	S141-Q143 PolarHBondContact O-N 3.27Å; Q143-G145 PolarHBondContact O-N 3.14Å; Q143-G145 VanDerWaalsContact O-N 3.11Å
144	I	40.3	Very low	67.8	Low	178 Å²	178	63.4 Å²	63.4	91%	0.913	33%	0.328	S	S	*	.	S	Bend	trans	-76.9	103.3	-177.9	-58.5	174.7	0	0	0	108.2
145	G	50.8	Low	67.5	Low	52 Å²	52	66.9 Å²	66.9	54%	0.536	35%	0.352	S	S	.	.	S	Bend	trans	165.7	175.6	179.8	0	0	0	0	0	111.7	Q143 Q147	Q143-G145 PolarHBondContact O-N 3.14Å; Q143-G145 VanDerWaalsContact O-N 3.11Å; G145-Q147 VanDerWaalsContact C-N 3.31Å; G145-Q147 PolarHBondContact O-N 3.49Å
146	Y	50.3	Low	67.5	Low	189 Å²	189	68.1 Å²	68.1	74%	0.741	36%	0.357	S	S	*	.	S	Bend	trans	-71.9	79.5	-179.9	-53.9	-62.3	0	0	0	111.7	E122	E122-Y146 HydrophobicContact CB-CD1 3.79Å; E122-Y146 HydrophobicContact CB-CG 4.22Å; E122-Y146 HydrophobicContact CG-CD1 3.63Å; E122-Y146 HydrophobicContact CG-CE1 3.97Å; E122-Y146 HydrophobicContact CG-CG 4.25Å; E122-Y146 VanDerWaalsContact OE1-CE1 3.26Å; E122-Y146 WeakPolarHBondContact OE1-CE1 3.38Å; E122-Y146 WeakPolarHBondContact OE2-CD1 3.22Å; E122-Y146 WeakPolarHBondContact OE2-CE1 3.34Å
147	Q	59.8	Low	67.8	Low	76 Å²	76	66.7 Å²	66.7	36%	0.355	35%	0.349	S	S	.	.			trans	-125.7	135.5	177.5	-72.4	-175.5	4.7	0	0	111.4	A139 G145 H149	A139-Q147 HydrophobicContact CB-CB 4.32Å; G145-Q147 VanDerWaalsContact C-N 3.31Å; G145-Q147 PolarHBondContact O-N 3.49Å; Q147-H149 PolarHBondContact O-N 3.48Å; Q147-H149 VanDerWaalsContact O-N 3.11Å
148	N	67.4	Low	68.4	Low	8 Å²	8	67.2 Å²	67.2	4%	0.043	35%	0.354	C	S	.	.			trans	-50.1	111.7	171.7	-78.9	-8.8	0	0	0	111.9	L123 D124 T136 P138 A139 I153	L123-N148 VanDerWaalsContact CA-OD1 3.24Å; L123-N148 WeakPolarHBondContact CA-OD1 3.47Å; D124-N148 PolarHBondContact N-OD1 2.89Å; D124-N148 PolarHBondContact O-ND2 2.87Å; D124-N148 VanDerWaalsContact O-ND2 3.08Å; T136-N148 PolarHBondContact O-ND2 3.07Å; P138-N148 CarbonylContact C-O 3.56Å; P138-N148 WeakPolarHBondContact CA-O 3.47Å; P138-N148 HydrophobicContact CB-CB 3.9Å; P138-N148 WeakPolarHBondContact CB-O 3.27Å; A139-N148 PolarHBondContact N-O 3.05Å; N148-I153 HydrophobicContact CB-CD1 3.72Å; N148-I153 HydrophobicContact CB-CG1 4.33Å
149	H	75.3	Confident	69.5	Low	58 Å²	58	71.4 Å²	71.4	27%	0.269	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-81.2	143	163.9	-69.6	-46.4	0	0	0	110.2	Q147 E151 D152 I153	Q147-H149 PolarHBondContact O-N 3.48Å; Q147-H149 VanDerWaalsContact O-N 3.11Å; H149-E151 VanDerWaalsContact C-N 3.28Å; H149-E151 PolarHBondContact O-N 2.85Å; H149-D152 HydrophobicContact CB-CB 4.34Å; H149-D152 WeakPolarHBondContact CB-OD2 3.45Å; H149-D152 IonicContact CD2-OD2 3.36Å; H149-D152 IonicContact CG-OD2 2.7Å; H149-D152 PolarHBondContact O-N 3.42Å; H149-I153 WeakPolarHBondContact O-CG1 3.17Å; H149-I153 PolarHBondContact O-N 3.3Å; H149-I153 VanDerWaalsContact O-N 3.11Å
150	V	80.3	Confident	70.9	Confident	4 Å²	4	74.4 Å²	74.4	2%	0.024	39%	0.39	C	S	.	.	H	α-helix	trans	-67.3	-37.1	-174.6	-159.5	0	0	0	0	110.8	P138 R154 Y175 K179 F180	P138-V150 HydrophobicContact CB-CB 4.41Å; P138-V150 HydrophobicContact CB-CG2 3.89Å; P138-V150 HydrophobicContact CG-CB 4.35Å; P138-V150 HydrophobicContact CG-CG1 4.21Å; P138-V150 HydrophobicContact CG-CG2 3.86Å; V150-R154 VanDerWaalsContact O-CB 3.27Å; V150-R154 WeakPolarHBondContact O-CB 3.43Å; V150-R154 PolarHBondContact O-N 2.89Å; V150-Y175 HydrophobicContact CG1-CD1 4.45Å; V150-Y175 HydrophobicContact CG1-CE1 4.25Å; V150-K179 HydrophobicContact CB-CD 4.12Å; V150-K179 HydrophobicContact CG1-CB 4.25Å; V150-K179 HydrophobicContact CG1-CD 3.75Å; V150-K179 HydrophobicContact CG2-CD 4.16Å; V150-F180 HydrophobicContact CG1-CE1 4.38Å; V150-F180 HydrophobicContact CG1-CE2 3.84Å; V150-F180 HydrophobicContact CG1-CZ 3.64Å
151	E	82.4	Confident	72.7	Confident	111 Å²	111	71.3 Å²	71.3	52%	0.519	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-38.7	-177.2	-66.3	63.9	-145.3	0	0	111.2	H149 R154 S155	H149-E151 VanDerWaalsContact C-N 3.28Å; H149-E151 PolarHBondContact O-N 2.85Å; E151-R154 PolarHBondContact O-N 3.07Å; E151-S155 WeakPolarHBondContact O-CB 3.3Å; E151-S155 PolarHBondContact O-N 3.42Å
152	D	83.4	Confident	74.9	Confident	85 Å²	85	70.4 Å²	70.4	46%	0.455	37%	0.372	S	S	.	.	H	α-helix	trans	-72.6	-42.3	175.4	-68.3	-44.8	0	0	0	112	L123 H149 R154 S155 F156	L123-D152 HydrophobicContact CD1-CB 4.22Å; L123-D152 HydrophobicContact CD2-CB 4.03Å; H149-D152 HydrophobicContact CB-CB 4.34Å; H149-D152 WeakPolarHBondContact CB-OD2 3.45Å; H149-D152 IonicContact CD2-OD2 3.36Å; H149-D152 IonicContact CG-OD2 2.7Å; H149-D152 PolarHBondContact O-N 3.42Å; D152-R154 VanDerWaalsContact C-N 3.29Å; D152-R154 PolarHBondContact O-N 2.84Å; D152-S155 PolarHBondContact O-N 2.68Å; D152-F156 WeakPolarHBondContact O-CB 3.1Å; D152-F156 PolarHBondContact O-N 3.34Å
153	I	85.8	Confident	77.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-57.6	-45.8	169.7	-69.6	-170.8	0	0	0	110.2	L123 I125 M135 P138 N148 H149 F156 L157 F180	L123-I153 HydrophobicContact CD2-CG1 4.26Å; I125-I153 HydrophobicContact CD1-CG1 4.26Å; M135-I153 HydrophobicContact CE-CD1 4.41Å; M135-I153 HydrophobicContact CE-CG2 4.12Å; M135-I153 HydrophobicContact SD-CD1 3.81Å; M135-I153 HydrophobicContact SD-CG2 3.64Å; P138-I153 HydrophobicContact CB-CD1 4.09Å; P138-I153 HydrophobicContact CG-CD1 4.39Å; N148-I153 HydrophobicContact CB-CD1 3.72Å; N148-I153 HydrophobicContact CB-CG1 4.33Å; H149-I153 WeakPolarHBondContact O-CG1 3.17Å; H149-I153 PolarHBondContact O-N 3.3Å; H149-I153 VanDerWaalsContact O-N 3.11Å; I153-F156 WeakPolarHBondContact O-CB 3.24Å; I153-F156 PolarHBondContact O-N 3.3Å; I153-L157 HydrophobicContact CG2-CD1 3.68Å; I153-L157 HydrophobicContact CG2-CG 4.15Å; I153-L157 WeakPolarHBondContact O-CB 3.26Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.47Å; I153-F180 HydrophobicContact CB-CZ 4.47Å; I153-F180 HydrophobicContact CG2-CE1 3.88Å; I153-F180 HydrophobicContact CG2-CZ 3.85Å
154	R	85.8	Confident	79.5	Confident	79 Å²	79	67.2 Å²	67.2	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-47.4	179	-169.9	-151.8	169.6	124.3	-5.5	110.5	V150 E151 D152 F156 L157 D158 A178 K179 F180 S181	V150-R154 VanDerWaalsContact O-CB 3.27Å; V150-R154 WeakPolarHBondContact O-CB 3.43Å; V150-R154 PolarHBondContact O-N 2.89Å; E151-R154 PolarHBondContact O-N 3.07Å; D152-R154 VanDerWaalsContact C-N 3.29Å; D152-R154 PolarHBondContact O-N 2.84Å; R154-F156 VanDerWaalsContact C-N 3.3Å; R154-F156 PolarHBondContact O-N 2.85Å; R154-L157 PolarHBondContact O-N 3.22Å; R154-D158 WeakPolarHBondContact CG-OD2 3.16Å; R154-D158 IonicContact CZ-OD2 3.64Å; R154-D158 IonicContact NE-OD2 3.69Å; R154-D158 PolarHBondContact NE-OD2 2.94Å; R154-D158 IonicContact NH2-OD2 2.77Å; R154-D158 VanDerWaalsContact O-CB 3.29Å; R154-D158 WeakPolarHBondContact O-CB 3.42Å; R154-D158 PolarHBondContact O-N 3.41Å; R154-A178 PolarHBondContact NH1-O 3.47Å; R154-K179 WeakPolarHBondContact CD-O 3.42Å; R154-K179 PolarHBondContact NH1-O 2.75Å; R154-F180 HydrophobicContact CB-CD1 4.06Å; R154-F180 HydrophobicContact CB-CE1 3.81Å; R154-F180 HydrophobicContact CG-CD1 4Å; R154-F180 HydrophobicContact CG-CE1 4.27Å; R154-S181 PolarHBondContact NH2-OG 2.93Å
155	S	87.1	Confident	82.1	Confident	74 Å²	74	58.8 Å²	58.8	52%	0.517	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-37.4	176.5	-171.5	0	0	0	0	112.4	E151 D152 S159	E151-S155 WeakPolarHBondContact O-CB 3.3Å; E151-S155 PolarHBondContact O-N 3.42Å; D152-S155 PolarHBondContact O-N 2.68Å; S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-N 3.14Å; S155-S159 PolarHBondContact O-OG 2.92Å
156	F	88.2	Confident	84.2	Confident	27 Å²	27	57.4 Å²	57.4	12%	0.118	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-50.1	174.9	178.3	-90.4	0	0	0	111.5	Y118 L123 I125 Y127 D152 I153 R154 S159 R160	Y118-F156 HydrophobicContact CD1-CE2 4.44Å; Y118-F156 HydrophobicContact CG-CE2 4.48Å; L123-F156 HydrophobicContact CD1-CB 4.26Å; I125-F156 HydrophobicContact CD1-CB 4.5Å; I125-F156 HydrophobicContact CD1-CD1 3.6Å; I125-F156 HydrophobicContact CD1-CE1 3.92Å; I125-F156 HydrophobicContact CD1-CG 4.03Å; I125-F156 HydrophobicContact CG2-CE1 4.12Å; Y127-F156 HydrophobicContact CE2-CE1 4.19Å; Y127-F156 HydrophobicContact CE2-CZ 4.03Å; D152-F156 WeakPolarHBondContact O-CB 3.1Å; D152-F156 PolarHBondContact O-N 3.34Å; I153-F156 WeakPolarHBondContact O-CB 3.24Å; I153-F156 PolarHBondContact O-N 3.3Å; R154-F156 VanDerWaalsContact C-N 3.3Å; R154-F156 PolarHBondContact O-N 2.85Å; F156-S159 PolarHBondContact O-N 3.05Å; F156-S159 PolarHBondContact O-OG 2.73Å; F156-R160 VanDerWaalsContact CE2-NE 3.28Å; F156-R160 PolarHBondContact O-N 3.19Å
157	L	90.8	Very high	86.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.8	-43.7	-178.9	-66.5	175.6	0	0	0	112.3	I133 I153 R154 S159 R160 H161 Y165 F180 V220	I133-L157 HydrophobicContact CD1-CD2 4.44Å; I153-L157 HydrophobicContact CG2-CD1 3.68Å; I153-L157 HydrophobicContact CG2-CG 4.15Å; I153-L157 WeakPolarHBondContact O-CB 3.26Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.47Å; R154-L157 PolarHBondContact O-N 3.22Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 2.83Å; L157-R160 PolarHBondContact O-N 3.4Å; L157-H161 CarbonylContact O-C 3.53Å; L157-H161 WeakPolarHBondContact O-CA 3.04Å; L157-H161 WeakPolarHBondContact O-CB 3.48Å; L157-H161 PolarHBondContact O-N 3.36Å; L157-Y165 HydrophobicContact CB-CD1 3.7Å; L157-Y165 HydrophobicContact CB-CD2 4.42Å; L157-Y165 HydrophobicContact CB-CE1 3.42Å; L157-Y165 VanDerWaalsContact CB-CE1 3.42Å; L157-Y165 HydrophobicContact CB-CE2 4.18Å; L157-Y165 HydrophobicContact CB-CG 4.19Å; L157-Y165 HydrophobicContact CD1-CD2 4Å; L157-Y165 HydrophobicContact CD1-CE2 3.85Å; L157-Y165 HydrophobicContact CD1-CG 4.43Å; L157-F180 HydrophobicContact CD1-CE1 4.32Å; L157-V220 HydrophobicContact CD1-CG1 4.18Å; L157-V220 HydrophobicContact CD1-CG2 4.15Å; L157-V220 HydrophobicContact CD2-CG2 3.77Å
158	D	90.3	Very high	88	Confident	45 Å²	45	45 Å²	45	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-64.9	-33.2	175.4	-77	-24	0	0	0	111.3	R154 A162 Y165 R183	R154-D158 WeakPolarHBondContact CG-OD2 3.16Å; R154-D158 IonicContact CZ-OD2 3.64Å; R154-D158 IonicContact NE-OD2 3.69Å; R154-D158 PolarHBondContact NE-OD2 2.94Å; R154-D158 IonicContact NH2-OD2 2.77Å; R154-D158 VanDerWaalsContact O-CB 3.29Å; R154-D158 WeakPolarHBondContact O-CB 3.42Å; R154-D158 PolarHBondContact O-N 3.41Å; D158-A162 WeakPolarHBondContact O-CB 3.32Å; D158-A162 PolarHBondContact O-N 2.93Å; D158-Y165 VanDerWaalsContact OD1-CE1 3.3Å; D158-Y165 WeakPolarHBondContact OD1-CE1 3.47Å; D158-Y165 PolarHBondContact OD1-OH 3.46Å; D158-R183 IonicContact OD1-CZ 3.89Å; D158-R183 IonicContact OD1-NH1 2.66Å; D158-R183 IonicContact OD1-NH2 3.16Å; D158-R183 PolarHBondContact OD1-NH2 3.48Å; D158-R183 IonicContact OD2-NH2 3.36Å
159	S	90.9	Very high	89.2	Confident	90 Å²	90	44.7 Å²	44.7	63%	0.629	24%	0.239	S	C	*	.	H	α-helix	trans	-75.6	-20.6	178.2	67.7	0	0	0	0	115.4	S155 F156 L157	S155-S159 WeakPolarHBondContact O-CB 3.37Å; S155-S159 PolarHBondContact O-N 3.14Å; S155-S159 PolarHBondContact O-OG 2.92Å; F156-S159 PolarHBondContact O-N 3.05Å; F156-S159 PolarHBondContact O-OG 2.73Å; L157-S159 VanDerWaalsContact C-N 3.31Å; L157-S159 PolarHBondContact O-N 2.83Å
160	R	90.6	Very high	90	Very high	83 Å²	83	42 Å²	42	31%	0.313	23%	0.226	S	C	.	.	H	α-helix	trans	-107.9	-37.2	-179.2	-68.4	-176	172.5	-78.9	0.2	113.7	Y118 Y127 F156 L157	Y118-R160 VanDerWaalsContact CG-NH2 3.31Å; Y127-R160 WeakPolarHBondContact OH-CD 3.47Å; F156-R160 VanDerWaalsContact CE2-NE 3.28Å; F156-R160 PolarHBondContact O-N 3.19Å; L157-R160 PolarHBondContact O-N 3.4Å
161	H	92.9	Very high	90.4	Very high	30 Å²	30	41.9 Å²	41.9	14%	0.139	23%	0.226	C	C	.	.	H	α-helix	trans	-132.9	35.9	-166.2	-56.9	-60	0	0	0	111.1	Y127 I133 L157 D163 H164 Y165 V218	Y127-H161 AromaticContact CE1-NE2 3.76Å; Y127-H161 AromaticContact CZ-NE2 3.85Å; Y127-H161 PolarHBondContact OH-NE2 2.93Å; Y127-H161 VanDerWaalsContact OH-NE2 3.13Å; I133-H161 WeakPolarHBondContact CD1-NE2 3.43Å; L157-H161 CarbonylContact O-C 3.53Å; L157-H161 WeakPolarHBondContact O-CA 3.04Å; L157-H161 WeakPolarHBondContact O-CB 3.48Å; L157-H161 PolarHBondContact O-N 3.36Å; H161-D163 PolarHBondContact O-N 2.97Å; H161-H164 WeakPolarHBondContact O-CA 3.36Å; H161-H164 PolarHBondContact O-N 3.21Å; H161-Y165 HydrophobicContact CB-CD1 4.1Å; H161-Y165 WeakPolarHBondContact O-CD1 3.44Å; H161-Y165 PolarHBondContact O-N 2.98Å; H161-V218 HydrophobicContact CB-CG2 4.12Å
162	A	91.3	Very high	90.6	Very high	54 Å²	54	41.6 Å²	41.6	45%	0.446	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.8	125	174.9	0	0	0	0	0	111.2	D158 H164	D158-A162 WeakPolarHBondContact O-CB 3.32Å; D158-A162 PolarHBondContact O-N 2.93Å; A162-H164 PolarHBondContact O-CD2 3.41Å; A162-H164 PolarHBondContact O-N 3.43Å
163	D	90.6	Very high	90.5	Very high	126 Å²	126	45.3 Å²	45.3	67%	0.674	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.8	7.7	-176.4	-55	-38	0	0	0	117.4	H161 R183	H161-D163 PolarHBondContact O-N 2.97Å; D163-R183 IonicContact OD1-NH1 2.62Å
164	H	95.1	Very high	90.3	Very high	43 Å²	43	49.8 Å²	49.8	20%	0.199	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	6.5	-173.9	-73.8	-55.4	0	0	0	114.7	H161 A162 N214 K216 N217 V218	H161-H164 WeakPolarHBondContact O-CA 3.36Å; H161-H164 PolarHBondContact O-N 3.21Å; A162-H164 PolarHBondContact O-CD2 3.41Å; A162-H164 PolarHBondContact O-N 3.43Å; H164-N214 PolarHBondContact CE1-ND2 2.75Å; H164-K216 HydrophobicContact CB-CB 4.32Å; H164-K216 WeakPolarHBondContact NE2-CD 3.15Å; H164-N217 PolarHBondContact ND1-OD1 2.83Å; H164-N217 CarbonylContact O-C 3.54Å; H164-N217 WeakPolarHBondContact O-CA 3.45Å; H164-V218 PolarHBondContact O-N 3.19Å
165	Y	95.4	Very high	89.9	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.5	170.3	71.9	-94.5	0	0	0	113.5	L157 D158 H161 V167 F180 R183 V218 V220	L157-Y165 HydrophobicContact CB-CD1 3.7Å; L157-Y165 HydrophobicContact CB-CD2 4.42Å; L157-Y165 HydrophobicContact CB-CE1 3.42Å; L157-Y165 VanDerWaalsContact CB-CE1 3.42Å; L157-Y165 HydrophobicContact CB-CE2 4.18Å; L157-Y165 HydrophobicContact CB-CG 4.19Å; L157-Y165 HydrophobicContact CD1-CD2 4Å; L157-Y165 HydrophobicContact CD1-CE2 3.85Å; L157-Y165 HydrophobicContact CD1-CG 4.43Å; D158-Y165 VanDerWaalsContact OD1-CE1 3.3Å; D158-Y165 WeakPolarHBondContact OD1-CE1 3.47Å; D158-Y165 PolarHBondContact OD1-OH 3.46Å; H161-Y165 HydrophobicContact CB-CD1 4.1Å; H161-Y165 WeakPolarHBondContact O-CD1 3.44Å; H161-Y165 PolarHBondContact O-N 2.98Å; Y165-V167 HydrophobicContact CD2-CG2 3.96Å; Y165-V167 HydrophobicContact CE2-CG2 3.95Å; Y165-F180 HydrophobicContact CE2-CB 4.36Å; Y165-F180 HydrophobicContact CE2-CD1 4.11Å; Y165-R183 VanDerWaalsContact CZ-CZ 3.45Å; Y165-R183 WeakPolarHBondContact O-CD 3.43Å; Y165-R183 PolarHBondContact OH-NH2 3.27Å; Y165-V218 WeakPolarHBondContact CA-O 3.42Å; Y165-V220 HydrophobicContact CD2-CG2 4.48Å
166	T	95.2	Very high	89.1	Confident	24 Å²	24	51.3 Å²	51.3	15%	0.147	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	134.2	162.9	-71.7	0	0	0	0	109.1	F168 W210 V218 V220	T166-F168 HydrophobicContact CG2-CD2 4.31Å; T166-F168 HydrophobicContact CG2-CE2 3.78Å; T166-F168 HydrophobicContact CG2-CZ 3.92Å; T166-W210 VanDerWaalsContact OG1-CE2 3.29Å; T166-W210 WeakPolarHBondContact OG1-CZ2 3.44Å; T166-V218 PolarHBondContact N-O 2.94Å; T166-V220 PolarHBondContact O-N 3.01Å
167	V	93.8	Very high	87.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.7	178.5	-175.5	0	0	0	0	110	M135 Y165 F180 R183 V184 S185 V220 T222	M135-V167 HydrophobicContact CE-CG1 3.96Å; Y165-V167 HydrophobicContact CD2-CG2 3.96Å; Y165-V167 HydrophobicContact CE2-CG2 3.95Å; V167-F180 HydrophobicContact CG2-CD2 4.15Å; V167-F180 HydrophobicContact CG2-CE2 4.47Å; V167-F180 HydrophobicContact CG2-CG 4.19Å; V167-R183 PolarHBondContact N-O 3.36Å; V167-V184 HydrophobicContact CB-CG2 4.36Å; V167-V184 CarbonylContact O-C 3.55Å; V167-V184 WeakPolarHBondContact O-CA 3.07Å; V167-S185 PolarHBondContact O-N 2.68Å; V167-V220 CarbonylContact C-O 3.5Å; V167-V220 VanDerWaalsContact CA-O 3.27Å; V167-V220 WeakPolarHBondContact CA-O 3.38Å; V167-V220 HydrophobicContact CG2-CB 4.28Å; V167-V220 HydrophobicContact CG2-CG1 4.39Å; V167-T222 HydrophobicContact CG1-CG2 3.79Å
168	F	94.9	Very high	86.2	Confident	5 Å²	5	56.2 Å²	56.2	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	103	172.6	-65.2	-91.3	0	0	0	108.6	T166 V203 N206 M207 C219 V220 T222	T166-F168 HydrophobicContact CG2-CD2 4.31Å; T166-F168 HydrophobicContact CG2-CE2 3.78Å; T166-F168 HydrophobicContact CG2-CZ 3.92Å; F168-V203 HydrophobicContact CD1-CG1 3.93Å; F168-V203 HydrophobicContact CE1-CG1 4.49Å; F168-N206 HydrophobicContact CE1-CB 4.26Å; F168-M207 HydrophobicContact CD1-CG 4.14Å; F168-M207 HydrophobicContact CD2-CG 3.99Å; F168-M207 HydrophobicContact CE1-CG 3.83Å; F168-M207 HydrophobicContact CE2-CG 3.68Å; F168-M207 HydrophobicContact CG-CG 4.22Å; F168-M207 HydrophobicContact CZ-CB 4.36Å; F168-M207 HydrophobicContact CZ-CG 3.59Å; F168-C219 HydrophobicContact CD2-CB 4.27Å; F168-C219 HydrophobicContact CE2-CB 4.11Å; F168-V220 PolarHBondContact N-O 3.16Å; F168-T222 PolarHBondContact O-N 2.99Å
169	N	92.9	Very high	85.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	107.9	-178.5	-178.6	18.9	0	0	0	110.4	S171 R173 Y175 V184 S185 E186 C187 T222	N169-S171 VanDerWaalsContact C-N 3.33Å; N169-S171 WeakPolarHBondContact OD1-CB 3.39Å; N169-S171 PolarHBondContact OD1-N 2.96Å; N169-S171 PolarHBondContact OD1-OG 3.21Å; N169-R173 PolarHBondContact ND2-O 3.19Å; N169-Y175 HydrophobicContact CB-CD2 4.24Å; N169-Y175 HydrophobicContact CB-CE2 3.92Å; N169-V184 HydrophobicContact CB-CG1 4.32Å; N169-S185 PolarHBondContact N-O 2.99Å; N169-E186 VanDerWaalsContact CB-OE2 3.22Å; N169-E186 WeakPolarHBondContact CB-OE2 3.25Å; N169-E186 PolarHBondContact ND2-OE2 2.89Å; N169-C187 WeakPolarHBondContact O-CA 3.49Å; N169-C187 VanDerWaalsContact O-CB 3.27Å; N169-C187 WeakPolarHBondContact O-CB 3.11Å; N169-C187 PolarHBondContact O-N 2.82Å; N169-T222 HydrophobicContact CB-CG2 4.04Å
170	L	92.9	Very high	84.5	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.27	C	S	.	.			trans	-85.4	-7.7	179.4	-45.8	-177.1	0	0	0	112.3	C187 W189 I221 T222 C223 P229 L233	L170-C187 HydrophobicContact CD2-CB 3.96Å; L170-W189 HydrophobicContact CB-CB 4.46Å; L170-W189 HydrophobicContact CB-CD2 4.25Å; L170-W189 HydrophobicContact CB-CE3 4.12Å; L170-W189 HydrophobicContact CB-CG 4.42Å; L170-W189 HydrophobicContact CD1-CE3 3.89Å; L170-W189 HydrophobicContact CD1-CZ3 3.83Å; L170-W189 HydrophobicContact CD2-CD2 4.03Å; L170-W189 HydrophobicContact CD2-CE3 4.08Å; L170-W189 HydrophobicContact CD2-CH2 4.27Å; L170-W189 HydrophobicContact CD2-CZ2 4.22Å; L170-W189 HydrophobicContact CD2-CZ3 4.2Å; L170-W189 HydrophobicContact CG-CE3 4.25Å; L170-W189 HydrophobicContact CG-CZ3 4.5Å; L170-W189 WeakPolarHBondContact O-CA 3.48Å; L170-W189 VanDerWaalsContact O-CB 3.28Å; L170-W189 WeakPolarHBondContact O-CB 3.33Å; L170-W189 PolarHBondContact O-N 2.79Å; L170-I221 HydrophobicContact CD1-CG2 3.58Å; L170-I221 HydrophobicContact CG-CG2 4.05Å; L170-T222 PolarHBondContact N-O 2.93Å; L170-C223 HydrophobicContact CB-CB 4.07Å; L170-P229 HydrophobicContact CB-CB 4.22Å; L170-P229 HydrophobicContact CD1-CB 4.14Å; L170-P229 WeakPolarHBondContact CD1-O 3.45Å; L170-L233 HydrophobicContact CD1-CB 4.08Å; L170-L233 HydrophobicContact CD1-CD2 3.98Å; L170-L233 HydrophobicContact CD2-CD2 3.69Å; L170-L233 HydrophobicContact CG-CD2 4.38Å
171	S	87.6	Confident	83.8	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.021	28%	0.275	C	S	.	.	S	Bend	trans	-80	158.8	176.4	78.2	0	0	0	0	112.1	Y137 N169 R173	Y137-S171 WeakPolarHBondContact CD2-OG 3.11Å; N169-S171 VanDerWaalsContact C-N 3.33Å; N169-S171 WeakPolarHBondContact OD1-CB 3.39Å; N169-S171 PolarHBondContact OD1-N 2.96Å; N169-S171 PolarHBondContact OD1-OG 3.21Å; S171-R173 PolarHBondContact O-N 3.03Å; S171-R173 PolarHBondContact OG-N 3.12Å; S171-R173 PolarHBondContact OG-O 3.12Å
172	Q	86.2	Confident	83.1	Confident	104 Å²	104	55.4 Å²	55.4	49%	0.486	30%	0.301	S	S	.	.	S	Bend	trans	-80.7	16.3	167.1	-66.5	170.7	-18.9	0	0	112.5	E320	Q172-E320 PolarHBondContact NE2-OE1 2.89Å
173	R	83.1	Confident	82.8	Confident	164 Å²	164	54.6 Å²	54.6	62%	0.619	29%	0.286	S	S	*	.			trans	-108.2	103.3	175	-66.8	-179	175.1	-174.5	-1.1	108.3	Y137 N169 S171	Y137-R173 HydrophobicContact CE1-CB 4.31Å; Y137-R173 HydrophobicContact CE2-CB 3.97Å; Y137-R173 WeakPolarHBondContact CE2-O 3.35Å; Y137-R173 PolarHBondContact OH-O 3.15Å; N169-R173 PolarHBondContact ND2-O 3.19Å; S171-R173 PolarHBondContact O-N 3.03Å; S171-R173 PolarHBondContact OG-N 3.12Å; S171-R173 PolarHBondContact OG-O 3.12Å
174	N	81.6	Confident	82.7	Confident	93 Å²	93	50.3 Å²	50.3	50%	0.497	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-72.8	145.8	-179.7	-63.5	-1.3	0	0	0	111.3	E186 N188	N174-E186 WeakPolarHBondContact CA-OE1 3.15Å; N174-E186 WeakPolarHBondContact CB-OE1 3.27Å; N174-N188 PolarHBondContact OD1-OD1 3.24Å
175	Y	77	Confident	82.6	Confident	20 Å²	20	50 Å²	50	8%	0.078	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-72.4	139.5	168.4	-72.6	-88.7	0	0	0	110	Y137 P138 V150 N169 G177 F180 V184 E186 T222	Y137-Y175 HydrophobicContact CD2-CE2 4.25Å; Y137-Y175 HydrophobicContact CE2-CD2 4.27Å; Y137-Y175 HydrophobicContact CE2-CE1 4.26Å; Y137-Y175 AromaticContact CE2-CE2 3.71Å; Y137-Y175 HydrophobicContact CE2-CE2 3.71Å; Y137-Y175 AromaticContact CE2-CZ 3.72Å; P138-Y175 WeakPolarHBondContact CD-OH 3.44Å; P138-Y175 HydrophobicContact CG-CE1 3.67Å; V150-Y175 HydrophobicContact CG1-CD1 4.45Å; V150-Y175 HydrophobicContact CG1-CE1 4.25Å; N169-Y175 HydrophobicContact CB-CD2 4.24Å; N169-Y175 HydrophobicContact CB-CE2 3.92Å; Y175-G177 PolarHBondContact O-N 2.82Å; Y175-F180 HydrophobicContact CD1-CD2 4.26Å; Y175-F180 AromaticContact CD1-CE2 3.87Å; Y175-F180 HydrophobicContact CD1-CE2 3.87Å; Y175-F180 HydrophobicContact CE1-CD2 4.32Å; Y175-F180 AromaticContact CE1-CE2 3.52Å; Y175-F180 HydrophobicContact CE1-CE2 3.52Å; Y175-F180 HydrophobicContact CE1-CZ 4.43Å; Y175-F180 AromaticContact CZ-CE2 3.95Å; Y175-V184 HydrophobicContact CD2-CG1 3.85Å; Y175-V184 HydrophobicContact CE2-CG1 4.49Å; Y175-E186 PolarHBondContact N-OE1 2.83Å; Y175-T222 HydrophobicContact CE2-CG2 4.12Å; Y175-T222 WeakPolarHBondContact OH-CG2 3.5Å
176	R	69.4	Low	82.4	Confident	166 Å²	166	52.8 Å²	52.8	63%	0.626	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-63.1	133.6	166.2	-55.8	-170.3	-162.8	-149.6	4.4	108.5	E140 K179	E140-R176 WeakPolarHBondContact OE1-CD 3.33Å; E140-R176 IonicContact OE1-CZ 2.89Å; E140-R176 IonicContact OE1-NE 2.7Å; E140-R176 PolarHBondContact OE1-NE 2.92Å; E140-R176 IonicContact OE2-CZ 3.3Å; E140-R176 IonicContact OE2-NE 2.65Å; E140-R176 PolarHBondContact OE2-NE 3.15Å; E140-R176 IonicContact OE2-NH2 2.66Å; E140-R176 PolarHBondContact OE2-NH2 2.89Å; R176-K179 WeakPolarHBondContact O-CG 3.46Å; R176-K179 PolarHBondContact O-N 3.14Å
177	G	57.4	Low	82.2	Confident	66 Å²	66	52.4 Å²	52.4	68%	0.68	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	155.5	-176.5	0	0	0	0	0	113.4	Y175 K179	Y175-G177 PolarHBondContact O-N 2.82Å; G177-K179 VanDerWaalsContact C-N 3.29Å; G177-K179 PolarHBondContact O-N 3.11Å
178	A	61.6	Low	82.1	Confident	63 Å²	63	55.6 Å²	55.6	52%	0.521	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	-15.1	-173.5	0	0	0	0	0	118.5	R154 F180 S181 N182	R154-A178 PolarHBondContact NH1-O 3.47Å; A178-F180 VanDerWaalsContact C-N 3.29Å; A178-F180 PolarHBondContact O-N 2.66Å; A178-F180 VanDerWaalsContact O-N 3.17Å; A178-S181 PolarHBondContact O-N 3.01Å; A178-N182 PolarHBondContact N-OD1 3.32Å; A178-N182 VanDerWaalsContact N-OD1 3.08Å
179	K	68.3	Low	81.9	Confident	46 Å²	46	55.6 Å²	55.6	20%	0.2	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-38.3	-178.7	-73.3	-156.1	-171.4	-169.8	0	114.5	E140 V150 R154 R176 G177	E140-K179 VanDerWaalsContact OE1-CE 3.31Å; E140-K179 WeakPolarHBondContact OE1-CE 3.4Å; E140-K179 IonicContact OE1-NZ 3.15Å; E140-K179 PolarHBondContact OE1-NZ 3.45Å; V150-K179 HydrophobicContact CB-CD 4.12Å; V150-K179 HydrophobicContact CG1-CB 4.25Å; V150-K179 HydrophobicContact CG1-CD 3.75Å; V150-K179 HydrophobicContact CG2-CD 4.16Å; R154-K179 WeakPolarHBondContact CD-O 3.42Å; R154-K179 PolarHBondContact NH1-O 2.75Å; R176-K179 WeakPolarHBondContact O-CG 3.46Å; R176-K179 PolarHBondContact O-N 3.14Å; G177-K179 VanDerWaalsContact C-N 3.29Å; G177-K179 PolarHBondContact O-N 3.11Å
180	F	75.8	Confident	81.6	Confident	1 Å²	1	56.4 Å²	56.4	0%	0.004	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	31.7	172.9	-65.7	-66.3	0	0	0	113.6	M135 V150 I153 R154 L157 Y165 V167 Y175 A178 N182 R183 V184	M135-F180 HydrophobicContact CE-CZ 4.47Å; V150-F180 HydrophobicContact CG1-CE1 4.38Å; V150-F180 HydrophobicContact CG1-CE2 3.84Å; V150-F180 HydrophobicContact CG1-CZ 3.64Å; I153-F180 HydrophobicContact CB-CZ 4.47Å; I153-F180 HydrophobicContact CG2-CE1 3.88Å; I153-F180 HydrophobicContact CG2-CZ 3.85Å; R154-F180 HydrophobicContact CB-CD1 4.06Å; R154-F180 HydrophobicContact CB-CE1 3.81Å; R154-F180 HydrophobicContact CG-CD1 4Å; R154-F180 HydrophobicContact CG-CE1 4.27Å; L157-F180 HydrophobicContact CD1-CE1 4.32Å; Y165-F180 HydrophobicContact CE2-CB 4.36Å; Y165-F180 HydrophobicContact CE2-CD1 4.11Å; V167-F180 HydrophobicContact CG2-CD2 4.15Å; V167-F180 HydrophobicContact CG2-CE2 4.47Å; V167-F180 HydrophobicContact CG2-CG 4.19Å; Y175-F180 HydrophobicContact CD1-CD2 4.26Å; Y175-F180 AromaticContact CD1-CE2 3.87Å; Y175-F180 HydrophobicContact CD1-CE2 3.87Å; Y175-F180 HydrophobicContact CE1-CD2 4.32Å; Y175-F180 AromaticContact CE1-CE2 3.52Å; Y175-F180 HydrophobicContact CE1-CE2 3.52Å; Y175-F180 HydrophobicContact CE1-CZ 4.43Å; Y175-F180 AromaticContact CZ-CE2 3.95Å; A178-F180 VanDerWaalsContact C-N 3.29Å; A178-F180 PolarHBondContact O-N 2.66Å; A178-F180 VanDerWaalsContact O-N 3.17Å; F180-N182 PolarHBondContact O-N 2.96Å; F180-R183 WeakPolarHBondContact O-CB 3.39Å; F180-R183 PolarHBondContact O-N 3.45Å; F180-R183 VanDerWaalsContact O-N 3.13Å; F180-R183 PolarHBondContact O-NE 3.08Å; F180-R183 VanDerWaalsContact O-NE 3.15Å; F180-V184 HydrophobicContact CB-CG2 3.88Å; F180-V184 HydrophobicContact CD2-CG2 3.86Å; F180-V184 HydrophobicContact CG-CG2 4.35Å
181	S	76.1	Confident	80.9	Confident	60 Å²	60	60.4 Å²	60.4	42%	0.42	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	39.3	-175.8	-51.4	0	0	0	0	113	R154 A178 R183	R154-S181 PolarHBondContact NH2-OG 2.93Å; A178-S181 PolarHBondContact O-N 3.01Å; S181-R183 PolarHBondContact O-N 3.14Å; S181-R183 VanDerWaalsContact O-N 3.16Å
182	N	79.1	Confident	80.6	Confident	125 Å²	125	68.4 Å²	68.4	67%	0.668	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	12.1	-177.6	-53.6	-22.5	0	0	0	116	A178 F180 V184	A178-N182 PolarHBondContact N-OD1 3.32Å; A178-N182 VanDerWaalsContact N-OD1 3.08Å; F180-N182 PolarHBondContact O-N 2.96Å; N182-V184 PolarHBondContact O-N 3.13Å
183	R	84.1	Confident	80.8	Confident	36 Å²	36	64.8 Å²	64.8	14%	0.136	34%	0.341	C	S	.	.			trans	-79.8	45.5	174	-62.6	172.6	-72.3	174.4	-7.1	112.5	D158 D163 Y165 V167 F180 S181	D158-R183 IonicContact OD1-CZ 3.89Å; D158-R183 IonicContact OD1-NH1 2.66Å; D158-R183 IonicContact OD1-NH2 3.16Å; D158-R183 PolarHBondContact OD1-NH2 3.48Å; D158-R183 IonicContact OD2-NH2 3.36Å; D163-R183 IonicContact OD1-NH1 2.62Å; Y165-R183 VanDerWaalsContact CZ-CZ 3.45Å; Y165-R183 WeakPolarHBondContact O-CD 3.43Å; Y165-R183 PolarHBondContact OH-NH2 3.27Å; V167-R183 PolarHBondContact N-O 3.36Å; F180-R183 WeakPolarHBondContact O-CB 3.39Å; F180-R183 PolarHBondContact O-N 3.45Å; F180-R183 VanDerWaalsContact O-N 3.13Å; F180-R183 PolarHBondContact O-NE 3.08Å; F180-R183 VanDerWaalsContact O-NE 3.15Å; S181-R183 PolarHBondContact O-N 3.14Å; S181-R183 VanDerWaalsContact O-N 3.16Å
184	V	90.1	Very high	81.3	Confident	37 Å²	37	57 Å²	57	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.4	-178.4	-170.8	0	0	0	0	110.6	V167 N169 Y175 F180 N182 E186	V167-V184 HydrophobicContact CB-CG2 4.36Å; V167-V184 CarbonylContact O-C 3.55Å; V167-V184 WeakPolarHBondContact O-CA 3.07Å; N169-V184 HydrophobicContact CB-CG1 4.32Å; Y175-V184 HydrophobicContact CD2-CG1 3.85Å; Y175-V184 HydrophobicContact CE2-CG1 4.49Å; F180-V184 HydrophobicContact CB-CG2 3.88Å; F180-V184 HydrophobicContact CD2-CG2 3.86Å; F180-V184 HydrophobicContact CG-CG2 4.35Å; N182-V184 PolarHBondContact O-N 3.13Å; V184-E186 HydrophobicContact CG1-CG 4.32Å
185	S	91.6	Very high	81.9	Confident	37 Å²	37	52.8 Å²	52.8	26%	0.259	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	109.2	167.1	-174.4	0	0	0	0	108.7	V167 N169 C187	V167-S185 PolarHBondContact O-N 2.68Å; N169-S185 PolarHBondContact N-O 2.99Å; S185-C187 PolarHBondContact O-N 3.13Å
186	E	91.8	Very high	82.7	Confident	58 Å²	58	53.2 Å²	53.2	27%	0.271	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	100.7	179.5	-55.3	-71	-155.8	0	0	110	N169 N174 Y175 V184 N188	N169-E186 VanDerWaalsContact CB-OE2 3.22Å; N169-E186 WeakPolarHBondContact CB-OE2 3.25Å; N169-E186 PolarHBondContact ND2-OE2 2.89Å; N174-E186 WeakPolarHBondContact CA-OE1 3.15Å; N174-E186 WeakPolarHBondContact CB-OE1 3.27Å; Y175-E186 PolarHBondContact N-OE1 2.83Å; V184-E186 HydrophobicContact CG1-CG 4.32Å; E186-N188 PolarHBondContact O-ND2 3.13Å
187	C	91.9	Very high	84	Confident	16 Å²	16	45.3 Å²	45.3	11%	0.108	27%	0.266	C	S	.	.			trans	-89.6	-20.8	-173.3	-53.5	0	0	0	0	114	N169 L170 S185 W189 V203	N169-C187 WeakPolarHBondContact O-CA 3.49Å; N169-C187 VanDerWaalsContact O-CB 3.27Å; N169-C187 WeakPolarHBondContact O-CB 3.11Å; N169-C187 PolarHBondContact O-N 2.82Å; L170-C187 HydrophobicContact CD2-CB 3.96Å; S185-C187 PolarHBondContact O-N 3.13Å; C187-W189 PolarHBondContact O-N 3.17Å; C187-V203 HydrophobicContact CB-CG2 4.26Å
188	N	90.4	Very high	85.7	Confident	66 Å²	66	45.2 Å²	45.2	35%	0.353	25%	0.247	S	C	.	.			trans	55.2	42.7	172.3	-65.9	-81.7	0	0	0	115.5	N174 E186	N174-N188 PolarHBondContact OD1-OD1 3.24Å; E186-N188 PolarHBondContact O-ND2 3.13Å
189	W	91.4	Very high	87.3	Confident	6 Å²	6	45.3 Å²	45.3	2%	0.023	24%	0.239	C	C	.	.			trans	-77.7	147.2	-178.7	-63.4	-1.4	0	0	0	112.6	L170 C187 P195 L200 V203 P229 L233	L170-W189 HydrophobicContact CB-CB 4.46Å; L170-W189 HydrophobicContact CB-CD2 4.25Å; L170-W189 HydrophobicContact CB-CE3 4.12Å; L170-W189 HydrophobicContact CB-CG 4.42Å; L170-W189 HydrophobicContact CD1-CE3 3.89Å; L170-W189 HydrophobicContact CD1-CZ3 3.83Å; L170-W189 HydrophobicContact CD2-CD2 4.03Å; L170-W189 HydrophobicContact CD2-CE3 4.08Å; L170-W189 HydrophobicContact CD2-CH2 4.27Å; L170-W189 HydrophobicContact CD2-CZ2 4.22Å; L170-W189 HydrophobicContact CD2-CZ3 4.2Å; L170-W189 HydrophobicContact CG-CE3 4.25Å; L170-W189 HydrophobicContact CG-CZ3 4.5Å; L170-W189 WeakPolarHBondContact O-CA 3.48Å; L170-W189 VanDerWaalsContact O-CB 3.28Å; L170-W189 WeakPolarHBondContact O-CB 3.33Å; L170-W189 PolarHBondContact O-N 2.79Å; C187-W189 PolarHBondContact O-N 3.17Å; W189-P195 HydrophobicContact CB-CB 4.46Å; W189-P195 HydrophobicContact CD2-CB 3.56Å; W189-P195 HydrophobicContact CD2-CG 3.91Å; W189-P195 HydrophobicContact CE3-CB 3.88Å; W189-P195 HydrophobicContact CE3-CG 3.71Å; W189-P195 HydrophobicContact CG-CB 3.83Å; W189-P195 HydrophobicContact CH2-CB 4.44Å; W189-P195 HydrophobicContact CH2-CG 3.93Å; W189-P195 HydrophobicContact CZ2-CB 4.16Å; W189-P195 HydrophobicContact CZ2-CG 4.12Å; W189-P195 HydrophobicContact CZ3-CB 4.32Å; W189-P195 HydrophobicContact CZ3-CG 3.72Å; W189-L200 HydrophobicContact CH2-CD1 3.5Å; W189-L200 HydrophobicContact CZ2-CD1 4.15Å; W189-L200 HydrophobicContact CZ3-CD1 4.27Å; W189-V203 HydrophobicContact CZ2-CB 4.1Å; W189-V203 HydrophobicContact CZ2-CG1 4.49Å; W189-V203 HydrophobicContact CZ2-CG2 4.04Å; W189-P229 HydrophobicContact CE3-CB 4.31Å; W189-L233 HydrophobicContact CH2-CB 3.74Å; W189-L233 HydrophobicContact CH2-CD1 3.92Å; W189-L233 HydrophobicContact CH2-CD2 4.21Å; W189-L233 HydrophobicContact CH2-CG 4.17Å; W189-L233 HydrophobicContact CZ3-CB 3.88Å
190	P	86.6	Confident	88.6	Confident	17 Å²	17	43.1 Å²	43.1	11%	0.11	23%	0.23	C	C	.	.			trans	-67.9	150.7	174.3	29.1	-36.2	0	0	0	111.9	Q193 E320	P190-Q193 HydrophobicContact CB-CG 3.65Å; P190-Q193 HydrophobicContact CG-CG 3.32Å; P190-E320 HydrophobicContact CB-CG 4.44Å
191	S	77.2	Confident	89.6	Confident	85 Å²	85	43.2 Å²	43.2	59%	0.594	23%	0.23	S	C	*	.	S	Bend	trans	-90	-6.9	-174.2	59.9	0	0	0	0	115.5
192	R	82.3	Confident	90.5	Very high	170 Å²	170	41.4 Å²	41.4	64%	0.642	22%	0.219	S	C	*	.	S	Bend	trans	-141	30.5	-173.5	-63.3	-172.7	-177.7	-83.2	1.1	113.6	W264 Q381	R192-W264 HydrophobicContact CB-CH2 4.14Å; R192-W264 HydrophobicContact CB-CZ3 4.43Å; R192-W264 WeakPolarHBondContact O-CZ3 3.38Å; R192-Q381 PolarHBondContact O-NE2 2.79Å
193	Q	90.1	Very high	91.3	Very high	29 Å²	29	35.9 Å²	35.9	14%	0.136	19%	0.19	C	C	.	.	S	Bend	trans	-160.8	165.8	170.7	63.3	-175.5	75	0	0	108.1	P190 G319	P190-Q193 HydrophobicContact CB-CG 3.65Å; P190-Q193 HydrophobicContact CG-CG 3.32Å; Q193-G319 PolarHBondContact NE2-O 3.01Å
194	A	92.6	Very high	92	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-65.8	145.9	171	0	0	0	0	0	109.9	Y270 Q383	A194-Y270 HydrophobicContact CB-CD1 3.8Å; A194-Y270 HydrophobicContact CB-CD2 4.13Å; A194-Y270 HydrophobicContact CB-CE1 4.24Å; A194-Y270 HydrophobicContact CB-CG 3.74Å; A194-Q383 PolarHBondContact O-NE2 2.84Å
195	P	94.4	Very high	92.2	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.026	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-58.1	157.9	167.7	29.4	-38.1	0	0	0	110.8	W189 L200 V232 Y270	W189-P195 HydrophobicContact CB-CB 4.46Å; W189-P195 HydrophobicContact CD2-CB 3.56Å; W189-P195 HydrophobicContact CD2-CG 3.91Å; W189-P195 HydrophobicContact CE3-CB 3.88Å; W189-P195 HydrophobicContact CE3-CG 3.71Å; W189-P195 HydrophobicContact CG-CB 3.83Å; W189-P195 HydrophobicContact CH2-CB 4.44Å; W189-P195 HydrophobicContact CH2-CG 3.93Å; W189-P195 HydrophobicContact CZ2-CB 4.16Å; W189-P195 HydrophobicContact CZ2-CG 4.12Å; W189-P195 HydrophobicContact CZ3-CB 4.32Å; W189-P195 HydrophobicContact CZ3-CG 3.72Å; P195-L200 HydrophobicContact CG-CB 4.06Å; P195-L200 HydrophobicContact CG-CD1 4.16Å; P195-L200 HydrophobicContact CG-CD2 4.5Å; P195-L200 HydrophobicContact CG-CG 4.47Å; P195-V232 HydrophobicContact CG-CG1 4.47Å; P195-Y270 WeakPolarHBondContact O-CD1 3.39Å; P195-Y270 WeakPolarHBondContact O-CE1 3.3Å
196	S	94.8	Very high	92.4	Very high	29 Å²	29	37 Å²	37	20%	0.203	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-56	143.2	169.1	54.9	0	0	0	0	110.6	H198 N199 L200 D354	S196-H198 PolarHBondContact O-N 3.32Å; S196-N199 PolarHBondContact O-N 2.82Å; S196-N199 WeakPolarHBondContact OG-CB 3.49Å; S196-N199 PolarHBondContact OG-N 2.7Å; S196-N199 PolarHBondContact OG-ND2 2.9Å; S196-L200 PolarHBondContact O-N 3.27Å; S196-D354 WeakPolarHBondContact CA-OD1 3.45Å; S196-D354 WeakPolarHBondContact CB-OD2 3.33Å
197	L	95.6	Very high	92.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.8	-34.2	179.8	-176.4	64.2	0	0	0	111.3	F201 Y270 V274 M277 D354 F388 W437	L197-F201 WeakPolarHBondContact O-CB 3.3Å; L197-F201 PolarHBondContact O-N 2.92Å; L197-Y270 HydrophobicContact CB-CE1 4.38Å; L197-V274 HydrophobicContact CD1-CG2 3.89Å; L197-M277 HydrophobicContact CD1-SD 3.95Å; L197-M277 HydrophobicContact CD2-CE 4.4Å; L197-M277 HydrophobicContact CD2-SD 3.82Å; L197-M277 HydrophobicContact CG-CE 4.49Å; L197-M277 HydrophobicContact CG-SD 4.15Å; L197-D354 WeakPolarHBondContact CB-OD1 3.23Å; L197-D354 PolarHBondContact N-OD1 3.08Å; L197-F388 HydrophobicContact CD2-CD2 4.35Å; L197-F388 HydrophobicContact CD2-CE2 3.56Å; L197-F388 HydrophobicContact CD2-CZ 4.42Å; L197-W437 HydrophobicContact CB-CH2 4.47Å; L197-W437 HydrophobicContact CB-CZ3 4.49Å; L197-W437 HydrophobicContact CD2-CH2 4.06Å; L197-W437 HydrophobicContact CD2-CZ3 4.31Å; L197-W437 HydrophobicContact CG-CH2 4.09Å; L197-W437 HydrophobicContact CG-CZ3 3.94Å
198	H	94.1	Very high	92.8	Very high	64 Å²	64	33.8 Å²	33.8	30%	0.296	18%	0.175	S	C	.	.	H	α-helix	trans	-54.7	-54.5	170	-171.1	118	0	0	0	111.5	S196 A202	S196-H198 PolarHBondContact O-N 3.32Å; H198-A202 WeakPolarHBondContact O-CB 3.29Å; H198-A202 PolarHBondContact O-N 2.9Å
199	N	94.7	Very high	93.1	Very high	66 Å²	66	33.9 Å²	33.9	35%	0.353	18%	0.175	S	C	.	.	H	α-helix	trans	-69.8	-37.7	-176.8	-69.8	-0.2	0	0	0	111.7	S196 A202 V203	S196-N199 PolarHBondContact O-N 2.82Å; S196-N199 WeakPolarHBondContact OG-CB 3.49Å; S196-N199 PolarHBondContact OG-N 2.7Å; S196-N199 PolarHBondContact OG-ND2 2.9Å; N199-A202 PolarHBondContact O-N 2.96Å; N199-V203 VanDerWaalsContact O-CG2 3.27Å; N199-V203 WeakPolarHBondContact O-CG2 3.4Å; N199-V203 PolarHBondContact O-N 2.94Å
200	L	96.7	Very high	93.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-52.2	176.7	-175.2	57.4	0	0	0	111.2	W189 P195 S196 A202 V203 C204 V232 L233 A236 V274	W189-L200 HydrophobicContact CH2-CD1 3.5Å; W189-L200 HydrophobicContact CZ2-CD1 4.15Å; W189-L200 HydrophobicContact CZ3-CD1 4.27Å; P195-L200 HydrophobicContact CG-CB 4.06Å; P195-L200 HydrophobicContact CG-CD1 4.16Å; P195-L200 HydrophobicContact CG-CD2 4.5Å; P195-L200 HydrophobicContact CG-CG 4.47Å; S196-L200 PolarHBondContact O-N 3.27Å; L200-A202 PolarHBondContact O-N 2.95Å; L200-V203 PolarHBondContact O-N 3.15Å; L200-C204 PolarHBondContact O-N 3.19Å; L200-C204 VanDerWaalsContact O-N 3.08Å; L200-C204 PolarHBondContact O-SG 3.05Å; L200-C204 VanDerWaalsContact O-SG 3.4Å; L200-V232 HydrophobicContact CD1-CG1 4.1Å; L200-V232 HydrophobicContact CD2-CG1 4.26Å; L200-L233 HydrophobicContact CD1-CD1 4.46Å; L200-A236 HydrophobicContact CD1-CB 3.77Å; L200-A236 HydrophobicContact CD2-CB 4.31Å; L200-A236 HydrophobicContact CG-CB 4.19Å; L200-V274 HydrophobicContact CD2-CG2 3.64Å; L200-V274 HydrophobicContact CG-CG2 3.87Å
201	F	95.8	Very high	93.8	Very high	3 Å²	3	34.9 Å²	34.9	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-65.2	-40.2	178.9	-166.7	-80	0	0	0	112	L197 C204 K205 F240 M277 V278 P436 W437 F440	L197-F201 WeakPolarHBondContact O-CB 3.3Å; L197-F201 PolarHBondContact O-N 2.92Å; F201-C204 PolarHBondContact O-N 3.16Å; F201-K205 HydrophobicContact CE1-CD 4.4Å; F201-K205 VanDerWaalsContact O-CB 3.28Å; F201-K205 WeakPolarHBondContact O-CB 3.49Å; F201-K205 PolarHBondContact O-N 2.91Å; F201-F240 HydrophobicContact CD1-CE2 4.37Å; F201-F240 HydrophobicContact CD2-CD2 4.47Å; F201-F240 HydrophobicContact CD2-CE2 4.08Å; F201-F240 HydrophobicContact CE1-CE2 4.07Å; F201-F240 HydrophobicContact CE2-CD2 4.31Å; F201-F240 AromaticContact CE2-CE2 3.77Å; F201-F240 HydrophobicContact CE2-CE2 3.77Å; F201-F240 HydrophobicContact CG-CE2 4.37Å; F201-F240 AromaticContact CZ-CE2 3.76Å; F201-F240 HydrophobicContact CZ-CE2 3.76Å; F201-F240 HydrophobicContact CZ-CZ 4.48Å; F201-M277 HydrophobicContact CD2-CE 3.54Å; F201-M277 HydrophobicContact CD2-SD 4.49Å; F201-M277 HydrophobicContact CE2-CB 4.26Å; F201-M277 HydrophobicContact CE2-CE 3.88Å; F201-M277 HydrophobicContact CG-CE 4.22Å; F201-V278 HydrophobicContact CE2-CG1 4.16Å; F201-P436 HydrophobicContact CB-CG 4.22Å; F201-P436 HydrophobicContact CD1-CB 4.06Å; F201-P436 HydrophobicContact CD1-CG 3.93Å; F201-P436 WeakPolarHBondContact CE1-O 3.28Å; F201-P436 HydrophobicContact CG-CG 4.47Å; F201-W437 HydrophobicContact CB-CE3 4.05Å; F201-W437 HydrophobicContact CB-CZ3 4.4Å; F201-W437 HydrophobicContact CD1-CB 4.13Å; F201-W437 HydrophobicContact CD1-CE3 4.38Å; F201-W437 HydrophobicContact CD2-CB 4.35Å; F201-W437 HydrophobicContact CD2-CE3 4.47Å; F201-W437 HydrophobicContact CE1-CB 3.73Å; F201-W437 HydrophobicContact CE2-CB 3.96Å; F201-W437 HydrophobicContact CG-CB 4.43Å; F201-W437 HydrophobicContact CG-CE3 4.06Å; F201-W437 HydrophobicContact CZ-CB 3.63Å; F201-F440 HydrophobicContact CE1-CB 4.33Å; F201-F440 HydrophobicContact CE1-CD1 4.26Å; F201-F440 HydrophobicContact CE1-CG 4.1Å; F201-F440 HydrophobicContact CZ-CB 4.28Å; F201-F440 AromaticContact CZ-CD1 3.72Å; F201-F440 HydrophobicContact CZ-CD1 3.72Å; F201-F440 HydrophobicContact CZ-CE1 4.28Å; F201-F440 AromaticContact CZ-CG 3.99Å; F201-F440 HydrophobicContact CZ-CG 3.99Å
202	A	95.2	Very high	94.6	Very high	22 Å²	22	35.8 Å²	35.8	18%	0.182	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-41.5	177.1	0	0	0	0	0	112.6	H198 N199 L200 K205 N206 P436	H198-A202 WeakPolarHBondContact O-CB 3.29Å; H198-A202 PolarHBondContact O-N 2.9Å; N199-A202 PolarHBondContact O-N 2.96Å; L200-A202 PolarHBondContact O-N 2.95Å; A202-K205 PolarHBondContact O-N 3.43Å; A202-N206 WeakPolarHBondContact O-CB 3.41Å; A202-N206 PolarHBondContact O-N 3.19Å; A202-N206 PolarHBondContact O-ND2 3.31Å; A202-P436 HydrophobicContact CB-CB 4.27Å; A202-P436 HydrophobicContact CB-CG 4.18Å
203	V	96.8	Very high	95.2	Very high	9 Å²	9	34 Å²	34	6%	0.055	17%	0.169	C	C	.	.	H	α-helix	trans	-70.5	-41.6	178.1	177.9	0	0	0	0	111.2	F168 C187 W189 N199 L200 K205 N206 M207 L233	F168-V203 HydrophobicContact CD1-CG1 3.93Å; F168-V203 HydrophobicContact CE1-CG1 4.49Å; C187-V203 HydrophobicContact CB-CG2 4.26Å; W189-V203 HydrophobicContact CZ2-CB 4.1Å; W189-V203 HydrophobicContact CZ2-CG1 4.49Å; W189-V203 HydrophobicContact CZ2-CG2 4.04Å; N199-V203 VanDerWaalsContact O-CG2 3.27Å; N199-V203 WeakPolarHBondContact O-CG2 3.4Å; N199-V203 PolarHBondContact O-N 2.94Å; L200-V203 PolarHBondContact O-N 3.15Å; V203-K205 PolarHBondContact O-N 3.16Å; V203-N206 PolarHBondContact O-N 3.45Å; V203-M207 HydrophobicContact CG1-CG 4.4Å; V203-M207 HydrophobicContact CG1-SD 4.18Å; V203-M207 WeakPolarHBondContact O-CB 3.47Å; V203-M207 WeakPolarHBondContact O-CG 3.1Å; V203-M207 PolarHBondContact O-N 3.05Å; V203-L233 HydrophobicContact CB-CD1 4.24Å; V203-L233 HydrophobicContact CG1-CD1 3.74Å; V203-L233 HydrophobicContact CG1-CD2 3.6Å; V203-L233 HydrophobicContact CG1-CG 4.35Å
204	C	97.1	Very high	95.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-58.1	-45.3	172	-68.3	0	0	0	0	112.1	L200 F201 N206 M207 H208 M237 F240	L200-C204 PolarHBondContact O-N 3.19Å; L200-C204 VanDerWaalsContact O-N 3.08Å; L200-C204 PolarHBondContact O-SG 3.05Å; L200-C204 VanDerWaalsContact O-SG 3.4Å; F201-C204 PolarHBondContact O-N 3.16Å; C204-N206 PolarHBondContact O-N 3.04Å; C204-M207 PolarHBondContact O-N 3.19Å; C204-H208 WeakPolarHBondContact O-CB 3.22Å; C204-H208 PolarHBondContact O-N 2.78Å; C204-M237 HydrophobicContact CB-SD 4.32Å; C204-F240 HydrophobicContact CB-CB 4.16Å; C204-F240 HydrophobicContact CB-CD1 4.05Å; C204-F240 HydrophobicContact CB-CD2 3.58Å; C204-F240 HydrophobicContact CB-CE1 4.33Å; C204-F240 HydrophobicContact CB-CE2 3.88Å; C204-F240 HydrophobicContact CB-CG 3.68Å; C204-F240 HydrophobicContact CB-CZ 4.25Å
205	K	94.9	Very high	95.6	Very high	52 Å²	52	40.2 Å²	40.2	23%	0.226	21%	0.209	C	C	.	.	H	α-helix	trans	-58.9	-43.2	175.1	-176	175	-176.2	173.4	0	112.1	F201 A202 V203 N209 F240 P436 F440	F201-K205 HydrophobicContact CE1-CD 4.4Å; F201-K205 VanDerWaalsContact O-CB 3.28Å; F201-K205 WeakPolarHBondContact O-CB 3.49Å; F201-K205 PolarHBondContact O-N 2.91Å; A202-K205 PolarHBondContact O-N 3.43Å; V203-K205 PolarHBondContact O-N 3.16Å; K205-N209 WeakPolarHBondContact O-CB 3.42Å; K205-N209 PolarHBondContact O-N 3.42Å; K205-N209 PolarHBondContact O-ND2 3.46Å; K205-N209 PolarHBondContact O-OD1 3.4Å; K205-F240 HydrophobicContact CB-CZ 4.08Å; K205-P436 PolarHBondContact NZ-O 3.11Å; K205-F440 HydrophobicContact CD-CD2 3.99Å; K205-F440 HydrophobicContact CD-CE2 4.22Å; K205-F440 HydrophobicContact CG-CD2 4.25Å; K205-F440 HydrophobicContact CG-CE2 3.96Å
206	N	95.5	Very high	95.7	Very high	81 Å²	81	46.6 Å²	46.6	43%	0.433	24%	0.237	S	C	.	.	H	α-helix	trans	-68.9	-42.4	178	-70.9	-15.1	0	0	0	112.5	F168 A202 V203 C204 N209 W210	F168-N206 HydrophobicContact CE1-CB 4.26Å; A202-N206 WeakPolarHBondContact O-CB 3.41Å; A202-N206 PolarHBondContact O-N 3.19Å; A202-N206 PolarHBondContact O-ND2 3.31Å; V203-N206 PolarHBondContact O-N 3.45Å; C204-N206 PolarHBondContact O-N 3.04Å; N206-N209 PolarHBondContact O-N 3.36Å; N206-W210 WeakPolarHBondContact O-CB 3.37Å; N206-W210 PolarHBondContact O-N 3.27Å
207	M	97.4	Very high	95.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.7	-47.7	173.4	-75.8	175.1	59.1	0	0	111.7	I132 F168 V203 C204 N209 W210 L211 C219 I221 L233 M237	I132-M207 HydrophobicContact CD1-CE 4.3Å; F168-M207 HydrophobicContact CD1-CG 4.14Å; F168-M207 HydrophobicContact CD2-CG 3.99Å; F168-M207 HydrophobicContact CE1-CG 3.83Å; F168-M207 HydrophobicContact CE2-CG 3.68Å; F168-M207 HydrophobicContact CG-CG 4.22Å; F168-M207 HydrophobicContact CZ-CB 4.36Å; F168-M207 HydrophobicContact CZ-CG 3.59Å; V203-M207 HydrophobicContact CG1-CG 4.4Å; V203-M207 HydrophobicContact CG1-SD 4.18Å; V203-M207 WeakPolarHBondContact O-CB 3.47Å; V203-M207 WeakPolarHBondContact O-CG 3.1Å; V203-M207 PolarHBondContact O-N 3.05Å; C204-M207 PolarHBondContact O-N 3.19Å; M207-N209 VanDerWaalsContact C-N 3.34Å; M207-N209 PolarHBondContact O-N 3Å; M207-W210 PolarHBondContact O-N 2.97Å; M207-L211 WeakPolarHBondContact O-CG 3.09Å; M207-L211 PolarHBondContact O-N 3.46Å; M207-C219 HydrophobicContact CE-CB 3.92Å; M207-C219 HydrophobicContact CG-CB 4.47Å; M207-I221 HydrophobicContact CE-CD1 3.85Å; M207-I221 HydrophobicContact CE-CG1 4.38Å; M207-I221 HydrophobicContact SD-CD1 4.36Å; M207-L233 HydrophobicContact SD-CD1 3.73Å; M207-L233 HydrophobicContact SD-CD2 3.65Å; M207-L233 HydrophobicContact SD-CG 3.72Å; M207-M237 HydrophobicContact CB-CE 3.89Å; M207-M237 HydrophobicContact CB-SD 3.96Å; M207-M237 HydrophobicContact CE-CB 4.22Å; M207-M237 HydrophobicContact CE-CE 4.41Å; M207-M237 HydrophobicContact CE-CG 3.77Å; M207-M237 HydrophobicContact CE-SD 4.02Å; M207-M237 HydrophobicContact SD-SD 4.5Å
208	H	95.9	Very high	95.9	Very high	7 Å²	7	45.7 Å²	45.7	3%	0.032	23%	0.23	C	C	.	.	H	α-helix	trans	-56.9	-48	177	176.3	-98.5	0	0	0	111.5	C204 W210 L211 K212 M237 F240	C204-H208 WeakPolarHBondContact O-CB 3.22Å; C204-H208 PolarHBondContact O-N 2.78Å; H208-W210 VanDerWaalsContact C-N 3.34Å; H208-W210 PolarHBondContact O-N 3.5Å; H208-L211 PolarHBondContact O-N 3.28Å; H208-K212 VanDerWaalsContact O-CB 3.27Å; H208-K212 WeakPolarHBondContact O-CB 3.47Å; H208-K212 PolarHBondContact O-N 3.3Å; H208-M237 HydrophobicContact CB-CE 4.11Å; H208-F240 HydrophobicContact CB-CD1 4.37Å; H208-F240 HydrophobicContact CB-CE1 3.8Å
209	N	95.1	Very high	96.1	Very high	67 Å²	67	42.7 Å²	42.7	36%	0.358	22%	0.216	S	C	.	.	H	α-helix	trans	-63.2	-38.5	178.7	-68.5	-11.7	0	0	0	112.3	K205 N206 M207 K212 Q213	K205-N209 WeakPolarHBondContact O-CB 3.42Å; K205-N209 PolarHBondContact O-N 3.42Å; K205-N209 PolarHBondContact O-ND2 3.46Å; K205-N209 PolarHBondContact O-OD1 3.4Å; N206-N209 PolarHBondContact O-N 3.36Å; M207-N209 VanDerWaalsContact C-N 3.34Å; M207-N209 PolarHBondContact O-N 3Å; N209-K212 PolarHBondContact O-N 2.89Å; N209-Q213 VanDerWaalsContact O-CG 3.27Å; N209-Q213 WeakPolarHBondContact O-CG 3.33Å; N209-Q213 PolarHBondContact O-N 2.86Å; N209-Q213 PolarHBondContact O-NE2 2.82Å
210	W	96.6	Very high	96.1	Very high	43 Å²	43	39.5 Å²	39.5	16%	0.163	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-44.3	175	174.2	-113.6	0	0	0	112.7	T166 N206 M207 H208 K212 Q213 N217 V218	T166-W210 VanDerWaalsContact OG1-CE2 3.29Å; T166-W210 WeakPolarHBondContact OG1-CZ2 3.44Å; N206-W210 WeakPolarHBondContact O-CB 3.37Å; N206-W210 PolarHBondContact O-N 3.27Å; M207-W210 PolarHBondContact O-N 2.97Å; H208-W210 VanDerWaalsContact C-N 3.34Å; H208-W210 PolarHBondContact O-N 3.5Å; W210-K212 VanDerWaalsContact C-N 3.33Å; W210-K212 PolarHBondContact O-N 2.91Å; W210-Q213 PolarHBondContact O-N 3.01Å; W210-N217 HydrophobicContact CD2-CB 4.31Å; W210-N217 HydrophobicContact CZ2-CB 4.13Å; W210-N217 WeakPolarHBondContact CZ3-ND2 3.44Å; W210-N217 WeakPolarHBondContact O-CB 3.08Å; W210-N217 PolarHBondContact O-ND2 2.95Å; W210-V218 PolarHBondContact NE1-O 2.89Å
211	L	96.5	Very high	96.1	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-69.8	-29.3	177.7	-63.2	177.1	0	0	0	112.6	R131 M207 H208 N217 M237 V449	R131-L211 HydrophobicContact CB-CD2 4.15Å; R131-L211 PolarHBondContact NH1-O 3.03Å; R131-L211 PolarHBondContact NH2-O 3.17Å; M207-L211 WeakPolarHBondContact O-CG 3.09Å; M207-L211 PolarHBondContact O-N 3.46Å; H208-L211 PolarHBondContact O-N 3.28Å; L211-N217 WeakPolarHBondContact CD2-O 3.45Å; L211-M237 HydrophobicContact CD1-CE 3.96Å; L211-V449 HydrophobicContact CB-CG2 3.8Å
212	K	95	Very high	95.8	Very high	103 Å²	103	39.4 Å²	39.4	45%	0.448	20%	0.198	S	C	.	.	H	α-helix	trans	-75.5	-23.2	176.8	-170.8	164.7	-175.9	163.9	0	113.5	H208 N209 W210 D444	H208-K212 VanDerWaalsContact O-CB 3.27Å; H208-K212 WeakPolarHBondContact O-CB 3.47Å; H208-K212 PolarHBondContact O-N 3.3Å; N209-K212 PolarHBondContact O-N 2.89Å; W210-K212 VanDerWaalsContact C-N 3.33Å; W210-K212 PolarHBondContact O-N 2.91Å; K212-D444 PolarHBondContact NZ-O 2.6Å; K212-D444 IonicContact NZ-OD2 2.61Å; K212-D444 PolarHBondContact NZ-OD2 3.05Å
213	Q	95.5	Very high	95.3	Very high	132 Å²	132	38.4 Å²	38.4	62%	0.617	19%	0.19	S	C	*	.	H	α-helix	trans	-67.8	-33.7	-179.9	-80.4	163.2	32.6	0	0	114.3	N209 W210	N209-Q213 VanDerWaalsContact O-CG 3.27Å; N209-Q213 WeakPolarHBondContact O-CG 3.33Å; N209-Q213 PolarHBondContact O-N 2.86Å; N209-Q213 PolarHBondContact O-NE2 2.82Å; W210-Q213 PolarHBondContact O-N 3.01Å
214	N	95.9	Very high	94.5	Very high	54 Å²	54	41 Å²	41	29%	0.289	21%	0.208	S	C	.	.			trans	-156.7	134.2	-179.8	-172.4	-49.4	0	0	0	109.6	R131 H164 K216 N217	R131-N214 PolarHBondContact NH2-O 3.06Å; H164-N214 PolarHBondContact CE1-ND2 2.75Å; N214-K216 PolarHBondContact O-N 2.7Å; N214-K216 WeakPolarHBondContact OD1-CB 3.35Å; N214-K216 PolarHBondContact OD1-N 2.65Å; N214-N217 HydrophobicContact CB-CB 4.48Å; N214-N217 WeakPolarHBondContact O-CB 3.34Å; N214-N217 PolarHBondContact O-N 2.93Å
215	P	95.3	Very high	93.3	Very high	106 Å²	106	44.4 Å²	44.4	69%	0.688	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.3	179.8	25.2	-35.6	0	0	0	114.1	R131 N217	R131-P215 VanDerWaalsContact CZ-O 3.29Å; R131-P215 PolarHBondContact NE-O 2.65Å; R131-P215 PolarHBondContact NH2-O 3.48Å; P215-N217 VanDerWaalsContact C-N 3.31Å
216	K	95.9	Very high	91.9	Very high	138 Å²	138	42 Å²	42	60%	0.6	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-16.3	173.6	-65.1	-178	175.8	-177.4	0	113.7	H164 N214	H164-K216 HydrophobicContact CB-CB 4.32Å; H164-K216 WeakPolarHBondContact NE2-CD 3.15Å; N214-K216 PolarHBondContact O-N 2.7Å; N214-K216 WeakPolarHBondContact OD1-CB 3.35Å; N214-K216 PolarHBondContact OD1-N 2.65Å
217	N	97.3	Very high	91.2	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.032	22%	0.22	C	C	.	.			trans	-66.7	140.9	-173.7	-77.5	1.4	0	0	0	111.5	R131 H164 W210 L211 N214 P215	R131-N217 VanDerWaalsContact CZ-O 3.29Å; R131-N217 PolarHBondContact NE-O 2.59Å; R131-N217 PolarHBondContact NH2-O 3.1Å; H164-N217 PolarHBondContact ND1-OD1 2.83Å; H164-N217 CarbonylContact O-C 3.54Å; H164-N217 WeakPolarHBondContact O-CA 3.45Å; W210-N217 HydrophobicContact CD2-CB 4.31Å; W210-N217 HydrophobicContact CZ2-CB 4.13Å; W210-N217 WeakPolarHBondContact CZ3-ND2 3.44Å; W210-N217 WeakPolarHBondContact O-CB 3.08Å; W210-N217 PolarHBondContact O-ND2 2.95Å; L211-N217 WeakPolarHBondContact CD2-O 3.45Å; N214-N217 HydrophobicContact CB-CB 4.48Å; N214-N217 WeakPolarHBondContact O-CB 3.34Å; N214-N217 PolarHBondContact O-N 2.93Å; P215-N217 VanDerWaalsContact C-N 3.31Å
218	V	97.5	Very high	90.8	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.03	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	148.1	176.2	-53.6	0	0	0	0	111.5	R131 I133 H161 H164 Y165 T166 W210 V220	R131-V218 HydrophobicContact CB-CG1 4.48Å; R131-V218 WeakPolarHBondContact O-CA 3.4Å; I133-V218 HydrophobicContact CD1-CB 4.46Å; I133-V218 HydrophobicContact CD1-CG2 4.09Å; H161-V218 HydrophobicContact CB-CG2 4.12Å; H164-V218 PolarHBondContact O-N 3.19Å; Y165-V218 WeakPolarHBondContact CA-O 3.42Å; T166-V218 PolarHBondContact N-O 2.94Å; W210-V218 PolarHBondContact NE1-O 2.89Å; V218-V220 HydrophobicContact CG2-CG2 4.44Å
219	C	97.8	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	127.6	171.5	-69.3	0	0	0	0	109.7	R131 I133 F168 M207	R131-C219 PolarHBondContact O-N 2.78Å; I133-C219 PolarHBondContact N-O 2.77Å; F168-C219 HydrophobicContact CD2-CB 4.27Å; F168-C219 HydrophobicContact CE2-CB 4.11Å; M207-C219 HydrophobicContact CE-CB 3.92Å; M207-C219 HydrophobicContact CG-CB 4.47Å
220	V	95.3	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	107.9	174.4	-180	0	0	0	0	108.4	I133 M135 L157 Y165 T166 V167 F168 V218	I133-V220 HydrophobicContact CB-CG2 4.26Å; I133-V220 HydrophobicContact CD1-CG2 4.16Å; I133-V220 HydrophobicContact CG2-CG1 4.45Å; M135-V220 HydrophobicContact CE-CG1 3.71Å; M135-V220 HydrophobicContact CG-CG1 4.1Å; M135-V220 HydrophobicContact SD-CG1 3.39Å; M135-V220 WeakPolarHBondContact SD-CG1 3.26Å; L157-V220 HydrophobicContact CD1-CG1 4.18Å; L157-V220 HydrophobicContact CD1-CG2 4.15Å; L157-V220 HydrophobicContact CD2-CG2 3.77Å; Y165-V220 HydrophobicContact CD2-CG2 4.48Å; T166-V220 PolarHBondContact O-N 3.01Å; V167-V220 CarbonylContact C-O 3.5Å; V167-V220 VanDerWaalsContact CA-O 3.27Å; V167-V220 WeakPolarHBondContact CA-O 3.38Å; V167-V220 HydrophobicContact CG2-CB 4.28Å; V167-V220 HydrophobicContact CG2-CG1 4.39Å; F168-V220 PolarHBondContact N-O 3.16Å; V218-V220 HydrophobicContact CG2-CG2 4.44Å
221	I	95	Very high	90.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	134.4	-177.6	-57.3	168.1	0	0	0	108.9	I132 I133 V134 M135 L170 M207 L233 V234	I132-I221 HydrophobicContact CG2-CD1 3.96Å; I133-I221 PolarHBondContact O-N 2.69Å; V134-I221 WeakPolarHBondContact CA-O 3.38Å; V134-I221 HydrophobicContact CG2-CB 4.38Å; M135-I221 PolarHBondContact N-O 2.8Å; L170-I221 HydrophobicContact CD1-CG2 3.58Å; L170-I221 HydrophobicContact CG-CG2 4.05Å; M207-I221 HydrophobicContact CE-CD1 3.85Å; M207-I221 HydrophobicContact CE-CG1 4.38Å; M207-I221 HydrophobicContact SD-CD1 4.36Å; I221-L233 HydrophobicContact CD1-CD2 4.04Å; I221-L233 HydrophobicContact CD1-CG 4.12Å; I221-L233 HydrophobicContact CG1-CD2 4.13Å; I221-L233 HydrophobicContact CG2-CD2 4.07Å; I221-V234 HydrophobicContact CD1-CG2 3.66Å
222	T	90.5	Very high	90.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	139.9	177.4	-171.2	0	0	0	0	113	M135 Y137 V167 F168 N169 L170 Y175	M135-T222 HydrophobicContact CE-CG2 3.98Å; M135-T222 VanDerWaalsContact O-CA 3.27Å; M135-T222 WeakPolarHBondContact O-CA 3.47Å; M135-T222 WeakPolarHBondContact O-CB 3.26Å; M135-T222 PolarHBondContact O-OG1 2.67Å; Y137-T222 WeakPolarHBondContact CA-OG1 3.47Å; Y137-T222 PolarHBondContact N-OG1 2.97Å; V167-T222 HydrophobicContact CG1-CG2 3.79Å; F168-T222 PolarHBondContact O-N 2.99Å; N169-T222 HydrophobicContact CB-CG2 4.04Å; L170-T222 PolarHBondContact N-O 2.93Å; Y175-T222 HydrophobicContact CE2-CG2 4.12Å; Y175-T222 WeakPolarHBondContact OH-CG2 3.5Å
223	C	85.4	Confident	90.4	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	169.2	172.6	76.5	0	0	0	0	110	Y137 L170 D225 G226 R227 P229 S230	Y137-C223 WeakPolarHBondContact CB-O 3.4Å; Y137-C223 PolarHBondContact N-O 3.02Å; L170-C223 HydrophobicContact CB-CB 4.07Å; C223-D225 PolarHBondContact O-N 2.81Å; C223-D225 PolarHBondContact SG-OD1 2.97Å; C223-D225 VanDerWaalsContact SG-OD1 3.34Å; C223-G226 PolarHBondContact O-N 3.39Å; C223-G226 VanDerWaalsContact O-N 3.15Å; C223-G226 WeakPolarHBondContact SG-CA 3.3Å; C223-G226 PolarHBondContact SG-N 3.45Å; C223-R227 PolarHBondContact SG-N 2.92Å; C223-P229 HydrophobicContact CB-CB 3.98Å; C223-P229 HydrophobicContact CB-CG 4.26Å; C223-S230 PolarHBondContact SG-OG 3.32Å
224	S	78.6	Confident	90.5	Very high	63 Å²	63	29.6 Å²	29.6	44%	0.441	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-29.1	-169.1	-49.5	0	0	0	0	116
225	D	71.4	Confident	90.5	Very high	73 Å²	73	27 Å²	27	39%	0.39	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-131.1	4.1	-177.5	68.9	-15.3	0	0	0	113.4	T136 C223 R227	T136-D225 VanDerWaalsContact OG1-C 3.28Å; T136-D225 PolarHBondContact OG1-O 3.1Å; C223-D225 PolarHBondContact O-N 2.81Å; C223-D225 PolarHBondContact SG-OD1 2.97Å; C223-D225 VanDerWaalsContact SG-OD1 3.34Å; D225-R227 WeakPolarHBondContact O-CG 3.21Å; D225-R227 PolarHBondContact O-N 3.17Å; D225-R227 PolarHBondContact OD1-N 3.48Å
226	G	66.3	Low	90.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.11	C	C	.	.	S	Bend	trans	60.5	17.8	-174.9	0	0	0	0	0	115.6	T136 C223 R258	T136-G226 WeakPolarHBondContact OG1-CA 3.36Å; T136-G226 PolarHBondContact OG1-N 3.03Å; C223-G226 PolarHBondContact O-N 3.39Å; C223-G226 VanDerWaalsContact O-N 3.15Å; C223-G226 WeakPolarHBondContact SG-CA 3.3Å; C223-G226 PolarHBondContact SG-N 3.45Å; G226-R258 PolarHBondContact O-NE 2.98Å; G226-R258 PolarHBondContact O-NH2 3.12Å
227	R	81.8	Confident	90.7	Very high	137 Å²	137	15.4 Å²	15.4	52%	0.517	8%	0.081	S	C	.	.	S	Bend	trans	-112	-105.9	-175.9	-62.6	166.7	-168.5	-139.2	1.8	112.2	C223 D225 S230 G231	C223-R227 PolarHBondContact SG-N 2.92Å; D225-R227 WeakPolarHBondContact O-CG 3.21Å; D225-R227 PolarHBondContact O-N 3.17Å; D225-R227 PolarHBondContact OD1-N 3.48Å; R227-S230 PolarHBondContact O-N 3.2Å; R227-G231 PolarHBondContact O-N 3.21Å
228	A	88.1	Confident	90.7	Very high	17 Å²	17	15.1 Å²	15.1	14%	0.14	8%	0.08	C	C	.	.	H	α-helix	trans	-61.8	-49.5	-156.1	0	0	0	0	0	114.1	S230 G231 V232 S261 L263	A228-S230 PolarHBondContact O-N 3.36Å; A228-G231 PolarHBondContact O-N 3.24Å; A228-G231 VanDerWaalsContact O-N 3.11Å; A228-V232 VanDerWaalsContact O-CG2 3.27Å; A228-V232 WeakPolarHBondContact O-CG2 3.49Å; A228-V232 PolarHBondContact O-N 3.16Å; A228-S261 WeakPolarHBondContact CA-O 3.35Å; A228-L263 HydrophobicContact CB-CD2 4.22Å; A228-L263 VanDerWaalsContact O-CD2 3.32Å; A228-L263 WeakPolarHBondContact O-CD2 3.29Å
229	P	92.4	Very high	90.6	Very high	17 Å²	17	15 Å²	15	11%	0.11	8%	0.079	C	C	.	.	H	α-helix	trans	-58.4	-43	177.3	-25.6	34.8	0	0	0	113.6	L170 W189 C223 G231 V232 L233	L170-P229 HydrophobicContact CB-CB 4.22Å; L170-P229 HydrophobicContact CD1-CB 4.14Å; L170-P229 WeakPolarHBondContact CD1-O 3.45Å; W189-P229 HydrophobicContact CE3-CB 4.31Å; C223-P229 HydrophobicContact CB-CB 3.98Å; C223-P229 HydrophobicContact CB-CG 4.26Å; P229-G231 VanDerWaalsContact C-N 3.33Å; P229-G231 PolarHBondContact O-N 3.38Å; P229-V232 PolarHBondContact O-N 3.27Å; P229-L233 PolarHBondContact O-N 3.02Å; P229-L233 VanDerWaalsContact O-N 3.14Å
230	S	93.1	Very high	90.5	Very high	2 Å²	2	15 Å²	15	1%	0.014	8%	0.079	C	C	.	.	H	α-helix	trans	-62.8	-40.8	175.4	-62	0	0	0	0	111.4	C223 R227 A228 L233 V234	C223-S230 PolarHBondContact SG-OG 3.32Å; R227-S230 PolarHBondContact O-N 3.2Å; A228-S230 PolarHBondContact O-N 3.36Å; S230-L233 PolarHBondContact O-N 3.03Å; S230-V234 WeakPolarHBondContact O-CB 3.29Å; S230-V234 WeakPolarHBondContact O-CG2 3.28Å; S230-V234 PolarHBondContact O-N 3.48Å
231	G	93.6	Very high	90.5	Very high	2 Å²	2	15 Å²	15	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-63.5	-38.8	175.1	0	0	0	0	0	113.4	R227 A228 P229 C235 L254	R227-G231 PolarHBondContact O-N 3.21Å; A228-G231 PolarHBondContact O-N 3.24Å; A228-G231 VanDerWaalsContact O-N 3.11Å; P229-G231 VanDerWaalsContact C-N 3.33Å; P229-G231 PolarHBondContact O-N 3.38Å; G231-C235 WeakPolarHBondContact O-CB 3.28Å; G231-C235 PolarHBondContact O-N 3.41Å; G231-C235 PolarHBondContact O-SG 3.05Å; G231-C235 VanDerWaalsContact O-SG 3.42Å; G231-L254 VanDerWaalsContact CA-CD2 3.43Å
232	V	95.5	Very high	90.4	Very high	1 Å²	1	18 Å²	18	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-58.6	-50	172.8	-172.7	0	0	0	0	110.3	P195 L200 A228 P229 A236 L263 H267 I271	P195-V232 HydrophobicContact CG-CG1 4.47Å; L200-V232 HydrophobicContact CD1-CG1 4.1Å; L200-V232 HydrophobicContact CD2-CG1 4.26Å; A228-V232 VanDerWaalsContact O-CG2 3.27Å; A228-V232 WeakPolarHBondContact O-CG2 3.49Å; A228-V232 PolarHBondContact O-N 3.16Å; P229-V232 PolarHBondContact O-N 3.27Å; V232-A236 WeakPolarHBondContact O-CB 3.28Å; V232-A236 PolarHBondContact O-N 3Å; V232-L263 HydrophobicContact CG2-CD2 4.11Å; V232-H267 HydrophobicContact CG2-CB 3.7Å; V232-I271 HydrophobicContact CG1-CG1 4.14Å
233	L	96.9	Very high	90.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66	-41.2	-177.8	-177.4	53.8	0	0	0	112.7	L170 W189 L200 V203 M207 I221 P229 S230 M237	L170-L233 HydrophobicContact CD1-CB 4.08Å; L170-L233 HydrophobicContact CD1-CD2 3.98Å; L170-L233 HydrophobicContact CD2-CD2 3.69Å; L170-L233 HydrophobicContact CG-CD2 4.38Å; W189-L233 HydrophobicContact CH2-CB 3.74Å; W189-L233 HydrophobicContact CH2-CD1 3.92Å; W189-L233 HydrophobicContact CH2-CD2 4.21Å; W189-L233 HydrophobicContact CH2-CG 4.17Å; W189-L233 HydrophobicContact CZ3-CB 3.88Å; L200-L233 HydrophobicContact CD1-CD1 4.46Å; V203-L233 HydrophobicContact CB-CD1 4.24Å; V203-L233 HydrophobicContact CG1-CD1 3.74Å; V203-L233 HydrophobicContact CG1-CD2 3.6Å; V203-L233 HydrophobicContact CG1-CG 4.35Å; M207-L233 HydrophobicContact SD-CD1 3.73Å; M207-L233 HydrophobicContact SD-CD2 3.65Å; M207-L233 HydrophobicContact SD-CG 3.72Å; I221-L233 HydrophobicContact CD1-CD2 4.04Å; I221-L233 HydrophobicContact CD1-CG 4.12Å; I221-L233 HydrophobicContact CG1-CD2 4.13Å; I221-L233 HydrophobicContact CG2-CD2 4.07Å; P229-L233 PolarHBondContact O-N 3.02Å; P229-L233 VanDerWaalsContact O-N 3.14Å; S230-L233 PolarHBondContact O-N 3.03Å; L233-M237 WeakPolarHBondContact O-CB 3.44Å; L233-M237 PolarHBondContact O-N 2.78Å
234	V	96.7	Very high	91	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.4	-49.4	178.7	171.8	0	0	0	0	111	I128 I132 V134 I221 S230 M237 F238 L254	I128-V234 HydrophobicContact CG2-CG1 4.06Å; I132-V234 HydrophobicContact CG2-CG2 4.14Å; V134-V234 HydrophobicContact CG2-CG2 3.73Å; I221-V234 HydrophobicContact CD1-CG2 3.66Å; S230-V234 WeakPolarHBondContact O-CB 3.29Å; S230-V234 WeakPolarHBondContact O-CG2 3.28Å; S230-V234 PolarHBondContact O-N 3.48Å; V234-M237 PolarHBondContact O-N 2.9Å; V234-F238 HydrophobicContact CG1-CD2 4.22Å; V234-F238 HydrophobicContact CG1-CE1 4.22Å; V234-F238 HydrophobicContact CG1-CE2 3.63Å; V234-F238 HydrophobicContact CG1-CZ 3.65Å; V234-F238 WeakPolarHBondContact O-CG 3.44Å; V234-F238 PolarHBondContact O-N 3Å; V234-L254 HydrophobicContact CB-CD1 4.45Å; V234-L254 HydrophobicContact CG1-CD1 4.11Å
235	C	96.6	Very high	91.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-66.1	-39.3	178.1	-66.6	0	0	0	0	112	G231 M237 F238 C239 A250 L254 I271	G231-C235 WeakPolarHBondContact O-CB 3.28Å; G231-C235 PolarHBondContact O-N 3.41Å; G231-C235 PolarHBondContact O-SG 3.05Å; G231-C235 VanDerWaalsContact O-SG 3.42Å; C235-M237 VanDerWaalsContact C-N 3.34Å; C235-M237 PolarHBondContact O-N 3.48Å; C235-F238 PolarHBondContact O-N 3.13Å; C235-C239 PolarHBondContact O-N 3.3Å; C235-C239 VanDerWaalsContact O-N 3.13Å; C235-A250 HydrophobicContact CB-CB 4.01Å; C235-A250 VanDerWaalsContact SG-C 3.6Å; C235-A250 PolarHBondContact SG-O 3.19Å; C235-A250 VanDerWaalsContact SG-O 3.38Å; C235-L254 VanDerWaalsContact SG-CD2 3.54Å; C235-I271 HydrophobicContact CB-CD1 3.62Å; C235-I271 HydrophobicContact CB-CG1 4.2Å; C235-I271 HydrophobicContact CB-CG2 4.16Å
236	A	97.4	Very high	92.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.8	-40.8	172.9	0	0	0	0	0	111.8	L200 V232 C239 F240 I271	L200-A236 HydrophobicContact CD1-CB 3.77Å; L200-A236 HydrophobicContact CD2-CB 4.31Å; L200-A236 HydrophobicContact CG-CB 4.19Å; V232-A236 WeakPolarHBondContact O-CB 3.28Å; V232-A236 PolarHBondContact O-N 3Å; A236-C239 PolarHBondContact O-N 3.14Å; A236-F240 WeakPolarHBondContact O-CB 3.42Å; A236-F240 PolarHBondContact O-N 3.17Å; A236-I271 HydrophobicContact CB-CG1 4.39Å
237	M	97.6	Very high	93.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.4	-37.9	176.9	-172.4	67	-179	0	0	112.5	I132 C204 M207 H208 L211 L233 V234 C235 F240 C241 L450	I132-M237 HydrophobicContact CD1-CG 3.9Å; C204-M237 HydrophobicContact CB-SD 4.32Å; M207-M237 HydrophobicContact CB-CE 3.89Å; M207-M237 HydrophobicContact CB-SD 3.96Å; M207-M237 HydrophobicContact CE-CB 4.22Å; M207-M237 HydrophobicContact CE-CE 4.41Å; M207-M237 HydrophobicContact CE-CG 3.77Å; M207-M237 HydrophobicContact CE-SD 4.02Å; M207-M237 HydrophobicContact SD-SD 4.5Å; H208-M237 HydrophobicContact CB-CE 4.11Å; L211-M237 HydrophobicContact CD1-CE 3.96Å; L233-M237 WeakPolarHBondContact O-CB 3.44Å; L233-M237 PolarHBondContact O-N 2.78Å; V234-M237 PolarHBondContact O-N 2.9Å; C235-M237 VanDerWaalsContact C-N 3.34Å; C235-M237 PolarHBondContact O-N 3.48Å; M237-F240 PolarHBondContact O-N 2.74Å; M237-F240 HydrophobicContact SD-CD1 4.46Å; M237-C241 VanDerWaalsContact CE-SG 3.56Å; M237-C241 PolarHBondContact O-N 3.21Å; M237-L450 HydrophobicContact CE-CD2 4Å; M237-L450 HydrophobicContact CG-CD2 3.92Å
238	F	96.6	Very high	93.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.1	-42.9	174.4	-66.7	-19.3	0	0	0	112.4	I128 T129 I132 V234 C235 H242 L243 F244 A250 L253 L450	I128-F238 HydrophobicContact CG2-CE2 4.25Å; I128-F238 HydrophobicContact CG2-CZ 3.76Å; T129-F238 HydrophobicContact CG2-CE1 4.11Å; T129-F238 HydrophobicContact CG2-CZ 4.3Å; I132-F238 HydrophobicContact CD1-CE1 4.31Å; V234-F238 HydrophobicContact CG1-CD2 4.22Å; V234-F238 HydrophobicContact CG1-CE1 4.22Å; V234-F238 HydrophobicContact CG1-CE2 3.63Å; V234-F238 HydrophobicContact CG1-CZ 3.65Å; V234-F238 WeakPolarHBondContact O-CG 3.44Å; V234-F238 PolarHBondContact O-N 3Å; C235-F238 PolarHBondContact O-N 3.13Å; F238-H242 PolarHBondContact O-N 2.99Å; F238-L243 HydrophobicContact CB-CB 4.3Å; F238-L243 HydrophobicContact CB-CD2 4.17Å; F238-L243 HydrophobicContact CD1-CD2 3.84Å; F238-L243 HydrophobicContact CD2-CD2 4.41Å; F238-L243 HydrophobicContact CE1-CD2 4.26Å; F238-L243 HydrophobicContact CG-CD2 3.91Å; F238-L243 WeakPolarHBondContact O-CB 3.42Å; F238-L243 PolarHBondContact O-N 2.92Å; F238-F244 HydrophobicContact CB-CD2 4.11Å; F238-F244 HydrophobicContact CD2-CE2 4.34Å; F238-A250 HydrophobicContact CB-CB 4.08Å; F238-A250 HydrophobicContact CD2-CB 4.14Å; F238-L253 HydrophobicContact CD2-CD2 4.26Å; F238-L253 HydrophobicContact CE2-CB 4.49Å; F238-L253 HydrophobicContact CE2-CD2 3.7Å; F238-L253 HydrophobicContact CE2-CG 4.11Å; F238-L253 HydrophobicContact CZ-CD2 4.01Å; F238-L450 HydrophobicContact CD1-CD1 3.88Å; F238-L450 HydrophobicContact CE1-CD1 4.43Å
239	C	95.4	Very high	93.8	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.007	11%	0.11	C	C	.	.	H	α-helix	trans	-67.4	-42.9	172.1	-69.1	0	0	0	0	111.8	C235 A236 C241 H242 F244 C275 V278	C235-C239 PolarHBondContact O-N 3.3Å; C235-C239 VanDerWaalsContact O-N 3.13Å; A236-C239 PolarHBondContact O-N 3.14Å; C239-C241 VanDerWaalsContact C-N 3.27Å; C239-C241 PolarHBondContact O-N 2.99Å; C239-H242 PolarHBondContact O-N 3.1Å; C239-F244 PolarHBondContact SG-O 3.06Å; C239-F244 VanDerWaalsContact SG-O 3.37Å; C239-C275 HydrophobicContact CB-CB 3.78Å; C239-V278 WeakPolarHBondContact O-CG2 3.46Å
240	F	96	Very high	93.9	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.3	-34.2	179.7	-171.8	-88.7	0	0	0	112.7	F201 C204 K205 H208 A236 M237 V274 V278 F440 L445	F201-F240 HydrophobicContact CD1-CE2 4.37Å; F201-F240 HydrophobicContact CD2-CD2 4.47Å; F201-F240 HydrophobicContact CD2-CE2 4.08Å; F201-F240 HydrophobicContact CE1-CE2 4.07Å; F201-F240 HydrophobicContact CE2-CD2 4.31Å; F201-F240 AromaticContact CE2-CE2 3.77Å; F201-F240 HydrophobicContact CE2-CE2 3.77Å; F201-F240 HydrophobicContact CG-CE2 4.37Å; F201-F240 AromaticContact CZ-CE2 3.76Å; F201-F240 HydrophobicContact CZ-CE2 3.76Å; F201-F240 HydrophobicContact CZ-CZ 4.48Å; C204-F240 HydrophobicContact CB-CB 4.16Å; C204-F240 HydrophobicContact CB-CD1 4.05Å; C204-F240 HydrophobicContact CB-CD2 3.58Å; C204-F240 HydrophobicContact CB-CE1 4.33Å; C204-F240 HydrophobicContact CB-CE2 3.88Å; C204-F240 HydrophobicContact CB-CG 3.68Å; C204-F240 HydrophobicContact CB-CZ 4.25Å; K205-F240 HydrophobicContact CB-CZ 4.08Å; H208-F240 HydrophobicContact CB-CD1 4.37Å; H208-F240 HydrophobicContact CB-CE1 3.8Å; A236-F240 WeakPolarHBondContact O-CB 3.42Å; A236-F240 PolarHBondContact O-N 3.17Å; M237-F240 PolarHBondContact O-N 2.74Å; M237-F240 HydrophobicContact SD-CD1 4.46Å; F240-V274 HydrophobicContact CB-CG1 4.24Å; F240-V274 HydrophobicContact CD2-CG1 4Å; F240-V278 HydrophobicContact CD2-CG1 3.62Å; F240-V278 HydrophobicContact CE2-CG1 4.02Å; F240-V278 HydrophobicContact CG-CG1 4.16Å; F240-F440 HydrophobicContact CE1-CE1 4.44Å; F240-F440 HydrophobicContact CE1-CZ 4.01Å; F240-F440 HydrophobicContact CE2-CE1 4.29Å; F240-F440 HydrophobicContact CE2-CZ 4.42Å; F240-F440 AromaticContact CZ-CE1 3.79Å; F240-F440 HydrophobicContact CZ-CE1 3.79Å; F240-F440 HydrophobicContact CZ-CE2 4.23Å; F240-F440 AromaticContact CZ-CZ 3.51Å; F240-F440 HydrophobicContact CZ-CZ 3.51Å; F240-L445 HydrophobicContact CD1-CD2 3.83Å; F240-L445 HydrophobicContact CE1-CD2 3.6Å; F240-L445 HydrophobicContact CZ-CD2 4.38Å; F240-L445 WeakPolarHBondContact O-CD1 3.44Å; F240-L445 WeakPolarHBondContact O-CD2 3.3Å
241	C	95.3	Very high	93.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	18.6	176.7	-64.7	0	0	0	0	113.9	M237 C239 L243 S446 P447 V449 L450	M237-C241 VanDerWaalsContact CE-SG 3.56Å; M237-C241 PolarHBondContact O-N 3.21Å; C239-C241 VanDerWaalsContact C-N 3.27Å; C239-C241 PolarHBondContact O-N 2.99Å; C241-L243 VanDerWaalsContact C-N 3.25Å; C241-L243 PolarHBondContact O-N 3.33Å; C241-S446 CarbonylContact O-C 3.58Å; C241-S446 VanDerWaalsContact O-C 3.22Å; C241-P447 VanDerWaalsContact O-CA 3.23Å; C241-P447 WeakPolarHBondContact O-CA 3.44Å; C241-P447 VanDerWaalsContact O-CD 3.26Å; C241-P447 WeakPolarHBondContact O-CD 3.2Å; C241-V449 HydrophobicContact CB-CG1 4.35Å; C241-L450 HydrophobicContact CB-CD1 4.01Å; C241-L450 HydrophobicContact CB-CD2 4.04Å; C241-L450 HydrophobicContact CB-CG 4.05Å
242	H	93.6	Very high	93.5	Very high	65 Å²	65	21.8 Å²	21.8	30%	0.301	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	30.7	-179.7	-57.2	-66.2	0	0	0	115.5	F238 C239 F244 V278 L445	F238-H242 PolarHBondContact O-N 2.99Å; C239-H242 PolarHBondContact O-N 3.1Å; H242-F244 VanDerWaalsContact C-N 3.35Å; H242-V278 PolarHBondContact CE1-O 3.39Å; H242-L445 VanDerWaalsContact CD2-CB 3.49Å; H242-L445 WeakPolarHBondContact CD2-CB 3.33Å
243	L	94.1	Very high	93.3	Very high	11 Å²	11	21.8 Å²	21.8	6%	0.058	12%	0.118	C	C	.	.	S	Bend	trans	-71.1	-36	167.5	-178.8	62.4	0	0	0	110.8	F238 C241 L253 P447 L450 F451 L461	F238-L243 HydrophobicContact CB-CB 4.3Å; F238-L243 HydrophobicContact CB-CD2 4.17Å; F238-L243 HydrophobicContact CD1-CD2 3.84Å; F238-L243 HydrophobicContact CD2-CD2 4.41Å; F238-L243 HydrophobicContact CE1-CD2 4.26Å; F238-L243 HydrophobicContact CG-CD2 3.91Å; F238-L243 WeakPolarHBondContact O-CB 3.42Å; F238-L243 PolarHBondContact O-N 2.92Å; C241-L243 VanDerWaalsContact C-N 3.25Å; C241-L243 PolarHBondContact O-N 3.33Å; L243-L253 HydrophobicContact CD2-CD2 4.06Å; L243-P447 HydrophobicContact CB-CB 4.02Å; L243-P447 HydrophobicContact CD1-CB 4.07Å; L243-L450 HydrophobicContact CB-CD1 3.88Å; L243-L450 HydrophobicContact CD2-CD1 3.94Å; L243-L450 HydrophobicContact CG-CD1 4.46Å; L243-F451 HydrophobicContact CD1-CE2 3.93Å; L243-F451 HydrophobicContact CD1-CZ 3.89Å; L243-F451 HydrophobicContact CD2-CE2 4.37Å; L243-F451 HydrophobicContact CD2-CZ 3.8Å; L243-L461 HydrophobicContact CD1-CD2 3.83Å; L243-L461 HydrophobicContact CD1-CG 4.3Å
244	F	93	Very high	93	Very high	17 Å²	17	21.9 Å²	21.9	8%	0.075	12%	0.119	C	C	.	.			trans	-142.5	127.5	176.7	-56.3	-64.9	0	0	0	111.6	F238 C239 H242 H246 P249 A250 L253 L461 A464	F238-F244 HydrophobicContact CB-CD2 4.11Å; F238-F244 HydrophobicContact CD2-CE2 4.34Å; C239-F244 PolarHBondContact SG-O 3.06Å; C239-F244 VanDerWaalsContact SG-O 3.37Å; H242-F244 VanDerWaalsContact C-N 3.35Å; F244-H246 PolarHBondContact O-N 3.25Å; F244-P249 HydrophobicContact CB-CB 4.13Å; F244-P249 HydrophobicContact CD1-CB 3.42Å; F244-P249 VanDerWaalsContact CD1-CB 3.42Å; F244-P249 HydrophobicContact CD1-CG 4.42Å; F244-P249 HydrophobicContact CD2-CB 4.23Å; F244-P249 HydrophobicContact CE1-CB 3.77Å; F244-P249 HydrophobicContact CG-CB 3.67Å; F244-P249 HydrophobicContact CZ-CB 4.31Å; F244-A250 HydrophobicContact CD2-CB 3.76Å; F244-A250 HydrophobicContact CE2-CB 4.43Å; F244-L253 HydrophobicContact CE2-CB 4.16Å; F244-L253 HydrophobicContact CE2-CD2 3.8Å; F244-L253 HydrophobicContact CZ-CB 4.29Å; F244-L253 HydrophobicContact CZ-CD2 3.99Å; F244-L461 HydrophobicContact CD1-CD2 4.46Å; F244-L461 HydrophobicContact CE1-CD2 3.86Å; F244-A464 HydrophobicContact CE1-CB 3.67Å; F244-A464 HydrophobicContact CZ-CB 3.67Å
245	S	87.9	Confident	92.7	Very high	95 Å²	95	24.9 Å²	24.9	66%	0.664	14%	0.139	S	C	*	.	S	Bend	trans	-74	0.4	176	-46.8	0	0	0	0	114.3	C275	S245-C275 PolarHBondContact O-SG 2.59Å
246	H	87.9	Confident	92.3	Very high	132 Å²	132	27.6 Å²	27.6	61%	0.611	16%	0.162	S	C	*	.	S	Bend	trans	-142.7	150.3	179.9	-68.7	-29.1	0	0	0	111.2	F244 V248	F244-H246 PolarHBondContact O-N 3.25Å; H246-V248 PolarHBondContact O-N 3.5Å
247	P	89.4	Confident	91.8	Very high	8 Å²	8	31.1 Å²	31.1	5%	0.052	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-27.2	-178.3	26.5	-35	0	0	0	114.3	A250 M251 I271 F482	P247-A250 WeakPolarHBondContact O-CB 3.31Å; P247-A250 PolarHBondContact O-N 3.37Å; P247-M251 WeakPolarHBondContact O-CG 3.32Å; P247-M251 PolarHBondContact O-N 3.33Å; P247-I271 HydrophobicContact CB-CB 4.25Å; P247-I271 HydrophobicContact CB-CG2 3.74Å; P247-F482 HydrophobicContact CG-CZ 4.18Å
248	V	90.5	Very high	91.1	Very high	35 Å²	35	32.5 Å²	32.5	21%	0.212	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-49.2	-173	173.4	0	0	0	0	112.7	H246 A250 M251 Q252 M476	H246-V248 PolarHBondContact O-N 3.5Å; V248-A250 VanDerWaalsContact C-N 3.31Å; V248-A250 PolarHBondContact O-N 2.76Å; V248-M251 WeakPolarHBondContact O-CB 3.15Å; V248-M251 PolarHBondContact O-N 3.15Å; V248-M251 VanDerWaalsContact O-N 3.13Å; V248-Q252 WeakPolarHBondContact O-CG 3.37Å; V248-Q252 PolarHBondContact O-N 2.97Å; V248-M476 HydrophobicContact CG1-CE 3.89Å; V248-M476 HydrophobicContact CG2-CE 4.13Å
249	P	91	Very high	90.4	Very high	28 Å²	28	37.4 Å²	37.4	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-56.4	-39.5	171	-29.9	37.7	0	0	0	114.3	F244 M251 Q252 L253 A464	F244-P249 HydrophobicContact CB-CB 4.13Å; F244-P249 HydrophobicContact CD1-CB 3.42Å; F244-P249 VanDerWaalsContact CD1-CB 3.42Å; F244-P249 HydrophobicContact CD1-CG 4.42Å; F244-P249 HydrophobicContact CD2-CB 4.23Å; F244-P249 HydrophobicContact CE1-CB 3.77Å; F244-P249 HydrophobicContact CG-CB 3.67Å; F244-P249 HydrophobicContact CZ-CB 4.31Å; P249-M251 VanDerWaalsContact C-N 3.31Å; P249-M251 PolarHBondContact O-N 2.92Å; P249-Q252 PolarHBondContact O-N 3.03Å; P249-L253 PolarHBondContact O-N 3.22Å; P249-A464 HydrophobicContact CB-CB 4.28Å
250	A	92.6	Very high	89.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-38.9	176.4	0	0	0	0	0	112	C235 F238 F244 P247 V248 L254	C235-A250 HydrophobicContact CB-CB 4.01Å; C235-A250 VanDerWaalsContact SG-C 3.6Å; C235-A250 PolarHBondContact SG-O 3.19Å; C235-A250 VanDerWaalsContact SG-O 3.38Å; F238-A250 HydrophobicContact CB-CB 4.08Å; F238-A250 HydrophobicContact CD2-CB 4.14Å; F244-A250 HydrophobicContact CD2-CB 3.76Å; F244-A250 HydrophobicContact CE2-CB 4.43Å; P247-A250 WeakPolarHBondContact O-CB 3.31Å; P247-A250 PolarHBondContact O-N 3.37Å; V248-A250 VanDerWaalsContact C-N 3.31Å; V248-A250 PolarHBondContact O-N 2.76Å; A250-L254 WeakPolarHBondContact O-CB 3.42Å; A250-L254 PolarHBondContact O-N 3.02Å; A250-L254 VanDerWaalsContact O-N 3.08Å
251	M	90.6	Very high	88.2	Confident	38 Å²	38	40 Å²	40	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-72	-33.8	175.2	-69.8	175	58.5	0	0	113	P247 V248 P249 S255 L263 C268	P247-M251 WeakPolarHBondContact O-CG 3.32Å; P247-M251 PolarHBondContact O-N 3.33Å; V248-M251 WeakPolarHBondContact O-CB 3.15Å; V248-M251 PolarHBondContact O-N 3.15Å; V248-M251 VanDerWaalsContact O-N 3.13Å; P249-M251 VanDerWaalsContact C-N 3.31Å; P249-M251 PolarHBondContact O-N 2.92Å; M251-S255 VanDerWaalsContact O-CB 3.28Å; M251-S255 WeakPolarHBondContact O-CB 3.32Å; M251-S255 PolarHBondContact O-N 2.66Å; M251-S255 PolarHBondContact O-OG 3.49Å; M251-L263 HydrophobicContact CE-CB 4.16Å; M251-L263 HydrophobicContact CE-CD1 4.34Å; M251-L263 HydrophobicContact CG-CD1 4.05Å; M251-L263 HydrophobicContact SD-CD1 4.34Å; M251-C268 HydrophobicContact SD-CB 4.36Å
252	Q	89.1	Confident	87.4	Confident	26 Å²	26	42.7 Å²	42.7	12%	0.121	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-48.9	174.4	-73.8	166.1	-39.6	0	0	111	V248 P249 L254 S255 A256 Q467 M468	V248-Q252 WeakPolarHBondContact O-CG 3.37Å; V248-Q252 PolarHBondContact O-N 2.97Å; P249-Q252 PolarHBondContact O-N 3.03Å; Q252-L254 PolarHBondContact O-N 3.06Å; Q252-S255 PolarHBondContact O-N 3.39Å; Q252-A256 PolarHBondContact O-N 3.07Å; Q252-Q467 HydrophobicContact CB-CB 4.32Å; Q252-Q467 HydrophobicContact CB-CG 4.33Å; Q252-Q467 HydrophobicContact CG-CB 4.43Å; Q252-Q467 HydrophobicContact CG-CG 4.21Å; Q252-M468 PolarHBondContact NE2-SD 3.44Å; Q252-M468 VanDerWaalsContact NE2-SD 3.42Å
253	L	90.7	Very high	87.2	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-44.9	175.8	178.7	61	0	0	0	111.9	F238 L243 F244 P249 S255 A256 K257 A460 I463	F238-L253 HydrophobicContact CD2-CD2 4.26Å; F238-L253 HydrophobicContact CE2-CB 4.49Å; F238-L253 HydrophobicContact CE2-CD2 3.7Å; F238-L253 HydrophobicContact CE2-CG 4.11Å; F238-L253 HydrophobicContact CZ-CD2 4.01Å; L243-L253 HydrophobicContact CD2-CD2 4.06Å; F244-L253 HydrophobicContact CE2-CB 4.16Å; F244-L253 HydrophobicContact CE2-CD2 3.8Å; F244-L253 HydrophobicContact CZ-CB 4.29Å; F244-L253 HydrophobicContact CZ-CD2 3.99Å; P249-L253 PolarHBondContact O-N 3.22Å; L253-S255 VanDerWaalsContact C-N 3.34Å; L253-S255 PolarHBondContact O-N 2.94Å; L253-A256 PolarHBondContact O-N 2.95Å; L253-K257 HydrophobicContact CD1-CG 4.37Å; L253-K257 PolarHBondContact O-N 2.89Å; L253-K257 VanDerWaalsContact O-N 3.14Å; L253-A460 HydrophobicContact CD1-CB 4.27Å; L253-A460 HydrophobicContact CD2-CB 3.97Å; L253-I463 HydrophobicContact CD1-CB 4.1Å; L253-I463 HydrophobicContact CD1-CD1 4.38Å; L253-I463 HydrophobicContact CD1-CG2 3.82Å
254	L	91.1	Very high	87.1	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-45.9	173.7	173.6	65	0	0	0	111.4	I128 G231 V234 C235 A250 Q252 A256 K257 R258	I128-L254 HydrophobicContact CD1-CD1 4.3Å; G231-L254 VanDerWaalsContact CA-CD2 3.43Å; V234-L254 HydrophobicContact CB-CD1 4.45Å; V234-L254 HydrophobicContact CG1-CD1 4.11Å; C235-L254 VanDerWaalsContact SG-CD2 3.54Å; A250-L254 WeakPolarHBondContact O-CB 3.42Å; A250-L254 PolarHBondContact O-N 3.02Å; A250-L254 VanDerWaalsContact O-N 3.08Å; Q252-L254 PolarHBondContact O-N 3.06Å; L254-A256 VanDerWaalsContact C-N 3.31Å; L254-A256 PolarHBondContact O-N 2.66Å; L254-K257 PolarHBondContact O-N 3.31Å; L254-R258 HydrophobicContact CD1-CB 4.42Å; L254-R258 CarbonylContact O-C 3.4Å; L254-R258 PolarHBondContact O-N 2.91Å
255	S	89.5	Confident	87.1	Confident	62 Å²	62	44.2 Å²	44.2	43%	0.434	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-31.4	-177.5	-59.5	0	0	0	0	112.8	M251 Q252 L253 P259	M251-S255 VanDerWaalsContact O-CB 3.28Å; M251-S255 WeakPolarHBondContact O-CB 3.32Å; M251-S255 PolarHBondContact O-N 2.66Å; M251-S255 PolarHBondContact O-OG 3.49Å; Q252-S255 PolarHBondContact O-N 3.39Å; L253-S255 VanDerWaalsContact C-N 3.34Å; L253-S255 PolarHBondContact O-N 2.94Å; S255-P259 WeakPolarHBondContact O-CA 3.36Å
256	A	87.8	Confident	87.5	Confident	57 Å²	57	39.7 Å²	39.7	47%	0.471	24%	0.244	S	C	.	.	H	α-helix	trans	-72	-30.8	173.9	0	0	0	0	0	113.1	Q252 L253 L254 I463	Q252-A256 PolarHBondContact O-N 3.07Å; L253-A256 PolarHBondContact O-N 2.95Å; L254-A256 VanDerWaalsContact C-N 3.31Å; L254-A256 PolarHBondContact O-N 2.66Å; A256-I463 HydrophobicContact CB-CG2 3.61Å
257	K	87.2	Confident	87.9	Confident	74 Å²	74	33.9 Å²	33.9	32%	0.322	22%	0.217	S	C	.	.	H	α-helix	trans	-91.1	-32.3	178.6	-67.2	-67.6	-172.2	-179.1	0	114.1	I128 L253 L254	I128-K257 HydrophobicContact CD1-CB 4.08Å; I128-K257 HydrophobicContact CG2-CB 3.99Å; I128-K257 HydrophobicContact CG2-CG 4.15Å; L253-K257 HydrophobicContact CD1-CG 4.37Å; L253-K257 PolarHBondContact O-N 2.89Å; L253-K257 VanDerWaalsContact O-N 3.14Å; L254-K257 PolarHBondContact O-N 3.31Å
258	R	84.3	Confident	88.1	Confident	29 Å²	29	33.9 Å²	33.9	11%	0.109	22%	0.217	C	C	.	.	S	Bend	trans	-147	80.5	-179.3	-167.4	171.2	178.2	87.6	4.6	110.2	D124 I128 G226 L254 S261	D124-R258 IonicContact OD1-CZ 3.61Å; D124-R258 IonicContact OD1-NH1 3.61Å; D124-R258 PolarHBondContact OD1-NH1 3.04Å; D124-R258 IonicContact OD1-NH2 2.67Å; D124-R258 PolarHBondContact OD1-NH2 3.24Å; D124-R258 VanDerWaalsContact OD1-NH2 3.09Å; D124-R258 IonicContact OD2-CZ 3.98Å; D124-R258 IonicContact OD2-NH1 2.72Å; D124-R258 IonicContact OD2-NH2 2.69Å; D124-R258 PolarHBondContact OD2-NH2 2.95Å; I128-R258 HydrophobicContact CD1-CB 3.84Å; G226-R258 PolarHBondContact O-NE 2.98Å; G226-R258 PolarHBondContact O-NH2 3.12Å; L254-R258 HydrophobicContact CD1-CB 4.42Å; L254-R258 CarbonylContact O-C 3.4Å; L254-R258 PolarHBondContact O-N 2.91Å; R258-S261 PolarHBondContact O-OG 2.99Å
259	P	81.1	Confident	88.3	Confident	104 Å²	104	33.6 Å²	33.6	68%	0.675	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	157.1	-179.3	25.9	-34.7	0	0	0	112.1	S255	S255-P259 WeakPolarHBondContact O-CA 3.36Å
260	G	72.9	Confident	88.6	Confident	50 Å²	50	32.3 Å²	32.3	52%	0.515	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	12.1	-179.4	0	0	0	0	0	115.4	G262	G260-G262 PolarHBondContact O-N 3.11Å
261	S	72.6	Confident	88.8	Confident	6 Å²	6	32.3 Å²	32.3	4%	0.042	20%	0.204	C	C	.	.			trans	-62.3	-21.9	177.3	-69.7	0	0	0	0	114.4	A228 R258 L263	A228-S261 WeakPolarHBondContact CA-O 3.35Å; R258-S261 PolarHBondContact O-OG 2.99Å; S261-L263 PolarHBondContact O-N 2.95Å
262	G	77.5	Confident	89.1	Confident	56 Å²	56	31 Å²	31	58%	0.577	20%	0.201	S	C	*	.			trans	61.3	38.5	158.9	0	0	0	0	0	117	G260 W264	G260-G262 PolarHBondContact O-N 3.11Å; G262-W264 PolarHBondContact O-N 2.86Å
263	L	89.3	Confident	89.5	Confident	31 Å²	31	30.5 Å²	30.5	16%	0.162	20%	0.198	C	C	.	.			trans	-67.1	131.9	-175.6	-57.6	-170.1	0	0	0	112.7	A228 V232 M251 S261 H267 I271	A228-L263 HydrophobicContact CB-CD2 4.22Å; A228-L263 VanDerWaalsContact O-CD2 3.32Å; A228-L263 WeakPolarHBondContact O-CD2 3.29Å; V232-L263 HydrophobicContact CG2-CD2 4.11Å; M251-L263 HydrophobicContact CE-CB 4.16Å; M251-L263 HydrophobicContact CE-CD1 4.34Å; M251-L263 HydrophobicContact CG-CD1 4.05Å; M251-L263 HydrophobicContact SD-CD1 4.34Å; S261-L263 PolarHBondContact O-N 2.95Å; L263-H267 HydrophobicContact CB-CB 4.21Å; L263-I271 HydrophobicContact CD1-CD1 3.9Å
264	W	92.2	Very high	89.7	Confident	67 Å²	67	30.5 Å²	30.5	25%	0.254	20%	0.197	S	C	.	.			trans	-80	157.6	176.3	-65.4	-5.6	0	0	0	111.8	R192 G262 S266 H267 C268 D404 A405	R192-W264 HydrophobicContact CB-CH2 4.14Å; R192-W264 HydrophobicContact CB-CZ3 4.43Å; R192-W264 WeakPolarHBondContact O-CZ3 3.38Å; G262-W264 PolarHBondContact O-N 2.86Å; W264-S266 VanDerWaalsContact C-N 3.26Å; W264-S266 PolarHBondContact O-N 2.75Å; W264-S266 VanDerWaalsContact O-N 3.16Å; W264-H267 PolarHBondContact N-ND1 3.32Å; W264-H267 WeakPolarHBondContact O-CA 3.33Å; W264-H267 VanDerWaalsContact O-CB 3.26Å; W264-H267 WeakPolarHBondContact O-CB 3.46Å; W264-H267 PolarHBondContact O-N 2.94Å; W264-C268 PolarHBondContact O-N 3.03Å; W264-C268 PolarHBondContact O-SG 2.77Å; W264-C268 VanDerWaalsContact O-SG 3.38Å; W264-D404 HydrophobicContact CB-CB 4.35Å; W264-D404 WeakPolarHBondContact CB-OD1 3.29Å; W264-D404 HydrophobicContact CD2-CB 4.13Å; W264-D404 HydrophobicContact CE3-CB 3.59Å; W264-D404 HydrophobicContact CG-CB 4.5Å; W264-D404 HydrophobicContact CZ3-CB 4.07Å; W264-A405 HydrophobicContact CH2-CB 3.92Å; W264-A405 HydrophobicContact CZ3-CB 4.18Å
265	P	94.8	Very high	89.9	Confident	27 Å²	27	30.9 Å²	30.9	18%	0.175	20%	0.2	C	C	.	.	H	α-helix	trans	-51.8	-38.7	179.8	-30.1	37.6	0	0	0	114.8	C268 R269 P401 E402 D404	P265-C268 WeakPolarHBondContact O-CB 3.43Å; P265-C268 PolarHBondContact O-N 3.39Å; P265-R269 WeakPolarHBondContact O-CB 3.41Å; P265-R269 PolarHBondContact O-N 3.21Å; P265-P401 WeakPolarHBondContact CG-O 3.39Å; P265-E402 WeakPolarHBondContact CB-O 3.24Å; P265-D404 WeakPolarHBondContact CD-OD1 3.48Å
266	S	96	Very high	90	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70.4	-28.2	175.9	-61.8	0	0	0	0	113.7	W264 R269 Y270 Q383 D404	W264-S266 VanDerWaalsContact C-N 3.26Å; W264-S266 PolarHBondContact O-N 2.75Å; W264-S266 VanDerWaalsContact O-N 3.16Å; S266-R269 PolarHBondContact O-N 2.94Å; S266-R269 PolarHBondContact OG-NH1 2.78Å; S266-Y270 WeakPolarHBondContact O-CD2 3.48Å; S266-Y270 PolarHBondContact O-N 2.56Å; S266-Q383 PolarHBondContact OG-N 2.97Å; S266-Q383 PolarHBondContact OG-O 2.78Å; S266-D404 WeakPolarHBondContact CB-OD1 3.38Å; S266-D404 WeakPolarHBondContact CB-OD2 3.45Å; S266-D404 PolarHBondContact N-OD1 3.05Å; S266-D404 PolarHBondContact OG-OD1 2.82Å; S266-D404 VanDerWaalsContact OG-OD1 3.12Å; S266-D404 PolarHBondContact OG-OD2 3.31Å
267	H	94.8	Very high	90.3	Very high	10 Å²	10	27 Å²	27	5%	0.046	17%	0.17	C	C	.	.	H	α-helix	trans	-63.5	-46.7	169.6	-59.7	168.5	0	0	0	109.9	V232 L263 W264 R269 Y270 I271	V232-H267 HydrophobicContact CG2-CB 3.7Å; L263-H267 HydrophobicContact CB-CB 4.21Å; W264-H267 PolarHBondContact N-ND1 3.32Å; W264-H267 WeakPolarHBondContact O-CA 3.33Å; W264-H267 VanDerWaalsContact O-CB 3.26Å; W264-H267 WeakPolarHBondContact O-CB 3.46Å; W264-H267 PolarHBondContact O-N 2.94Å; H267-R269 VanDerWaalsContact C-N 3.3Å; H267-R269 PolarHBondContact O-N 2.8Å; H267-Y270 PolarHBondContact O-N 3.46Å; H267-I271 WeakPolarHBondContact O-CD1 3.32Å; H267-I271 VanDerWaalsContact O-CG1 3.31Å; H267-I271 WeakPolarHBondContact O-CG1 3.31Å; H267-I271 PolarHBondContact O-N 3.4Å
268	C	94.3	Very high	90.5	Very high	8 Å²	8	23.6 Å²	23.6	5%	0.054	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-40.3	176.4	-51.7	0	0	0	0	111.8	M251 W264 P265 G272	M251-C268 HydrophobicContact SD-CB 4.36Å; W264-C268 PolarHBondContact O-N 3.03Å; W264-C268 PolarHBondContact O-SG 2.77Å; W264-C268 VanDerWaalsContact O-SG 3.38Å; P265-C268 WeakPolarHBondContact O-CB 3.43Å; P265-C268 PolarHBondContact O-N 3.39Å; C268-G272 PolarHBondContact O-N 3.11Å
269	R	95.9	Very high	90.8	Very high	29 Å²	29	24 Å²	24	11%	0.109	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-42.7	175.7	-162.9	177.4	-63.7	113	5.8	112	P265 S266 H267 G272 Y273 Q383 E402	P265-R269 WeakPolarHBondContact O-CB 3.41Å; P265-R269 PolarHBondContact O-N 3.21Å; S266-R269 PolarHBondContact O-N 2.94Å; S266-R269 PolarHBondContact OG-NH1 2.78Å; H267-R269 VanDerWaalsContact C-N 3.3Å; H267-R269 PolarHBondContact O-N 2.8Å; R269-G272 WeakPolarHBondContact O-CA 3.18Å; R269-G272 PolarHBondContact O-N 2.65Å; R269-Y273 HydrophobicContact CG-CE1 4.23Å; R269-Y273 HydrophobicContact CG-CE2 4.28Å; R269-Y273 PolarHBondContact O-N 2.88Å; R269-Q383 PolarHBondContact NH1-O 2.9Å; R269-E402 PolarHBondContact NH2-O 2.85Å; R269-E402 VanDerWaalsContact NH2-O 3.13Å
270	Y	97.4	Very high	91	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-74.2	-35.5	179.4	-86.7	-126.1	0	0	0	113.3	A194 P195 L197 S266 H267 G272 Y273 V274 D354 Q383 F384	A194-Y270 HydrophobicContact CB-CD1 3.8Å; A194-Y270 HydrophobicContact CB-CD2 4.13Å; A194-Y270 HydrophobicContact CB-CE1 4.24Å; A194-Y270 HydrophobicContact CB-CG 3.74Å; P195-Y270 WeakPolarHBondContact O-CD1 3.39Å; P195-Y270 WeakPolarHBondContact O-CE1 3.3Å; L197-Y270 HydrophobicContact CB-CE1 4.38Å; S266-Y270 WeakPolarHBondContact O-CD2 3.48Å; S266-Y270 PolarHBondContact O-N 2.56Å; H267-Y270 PolarHBondContact O-N 3.46Å; Y270-G272 VanDerWaalsContact C-N 3.26Å; Y270-G272 PolarHBondContact O-N 3.07Å; Y270-Y273 AromaticContact CD2-CD2 3.85Å; Y270-Y273 HydrophobicContact CD2-CD2 3.85Å; Y270-Y273 AromaticContact CD2-CE2 3.68Å; Y270-Y273 HydrophobicContact CD2-CE2 3.68Å; Y270-Y273 HydrophobicContact CE2-CD2 4.16Å; Y270-Y273 AromaticContact CE2-CE2 3.66Å; Y270-Y273 HydrophobicContact CE2-CE2 3.66Å; Y270-Y273 HydrophobicContact CG-CD2 4.07Å; Y270-Y273 HydrophobicContact CG-CE2 4.36Å; Y270-Y273 PolarHBondContact O-N 2.84Å; Y270-V274 PolarHBondContact O-N 3.17Å; Y270-V274 VanDerWaalsContact O-N 3.16Å; Y270-D354 VanDerWaalsContact CE1-OD1 3.26Å; Y270-D354 WeakPolarHBondContact CE1-OD1 3.27Å; Y270-D354 WeakPolarHBondContact OH-CB 3.41Å; Y270-D354 PolarHBondContact OH-OD1 2.91Å; Y270-Q383 HydrophobicContact CE2-CG 3.69Å; Y270-Q383 VanDerWaalsContact CZ-NE2 3.3Å; Y270-Q383 WeakPolarHBondContact OH-CG 3.49Å; Y270-Q383 PolarHBondContact OH-NE2 3.48Å; Y270-Q383 VanDerWaalsContact OH-NE2 3.16Å; Y270-F384 PolarHBondContact OH-O 2.88Å
271	I	96.6	Very high	91.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.6	-41.3	167.6	-61.9	156.3	0	0	0	109.6	V232 C235 A236 P247 L263 H267 V274 C275	V232-I271 HydrophobicContact CG1-CG1 4.14Å; C235-I271 HydrophobicContact CB-CD1 3.62Å; C235-I271 HydrophobicContact CB-CG1 4.2Å; C235-I271 HydrophobicContact CB-CG2 4.16Å; A236-I271 HydrophobicContact CB-CG1 4.39Å; P247-I271 HydrophobicContact CB-CB 4.25Å; P247-I271 HydrophobicContact CB-CG2 3.74Å; L263-I271 HydrophobicContact CD1-CD1 3.9Å; H267-I271 WeakPolarHBondContact O-CD1 3.32Å; H267-I271 VanDerWaalsContact O-CG1 3.31Å; H267-I271 WeakPolarHBondContact O-CG1 3.31Å; H267-I271 PolarHBondContact O-N 3.4Å; I271-V274 PolarHBondContact O-N 3.05Å; I271-C275 WeakPolarHBondContact O-CB 3.3Å; I271-C275 PolarHBondContact O-N 3.09Å
272	G	95.9	Very high	92.3	Very high	12 Å²	12	35.6 Å²	35.6	12%	0.124	20%	0.196	C	C	.	.	H	α-helix	trans	-57	-47.5	173.1	0	0	0	0	0	113.4	C268 R269 Y270 V274 C275 S276	C268-G272 PolarHBondContact O-N 3.11Å; R269-G272 WeakPolarHBondContact O-CA 3.18Å; R269-G272 PolarHBondContact O-N 2.65Å; Y270-G272 VanDerWaalsContact C-N 3.26Å; Y270-G272 PolarHBondContact O-N 3.07Å; G272-V274 PolarHBondContact O-N 3.13Å; G272-C275 WeakPolarHBondContact O-CB 3.21Å; G272-C275 PolarHBondContact O-N 3.05Å; G272-S276 PolarHBondContact O-N 2.8Å; G272-S276 PolarHBondContact O-OG 3.06Å
273	Y	96.8	Very high	93	Very high	15 Å²	15	36.6 Å²	36.6	6%	0.059	19%	0.192	C	C	.	.	H	α-helix	trans	-56.8	-49.3	175.6	-62.1	-31.1	0	0	0	112	R269 Y270 C275 S276 M277 H385 F388	R269-Y273 HydrophobicContact CG-CE1 4.23Å; R269-Y273 HydrophobicContact CG-CE2 4.28Å; R269-Y273 PolarHBondContact O-N 2.88Å; Y270-Y273 AromaticContact CD2-CD2 3.85Å; Y270-Y273 HydrophobicContact CD2-CD2 3.85Å; Y270-Y273 AromaticContact CD2-CE2 3.68Å; Y270-Y273 HydrophobicContact CD2-CE2 3.68Å; Y270-Y273 HydrophobicContact CE2-CD2 4.16Å; Y270-Y273 AromaticContact CE2-CE2 3.66Å; Y270-Y273 HydrophobicContact CE2-CE2 3.66Å; Y270-Y273 HydrophobicContact CG-CD2 4.07Å; Y270-Y273 HydrophobicContact CG-CE2 4.36Å; Y270-Y273 PolarHBondContact O-N 2.84Å; Y273-C275 VanDerWaalsContact C-N 3.3Å; Y273-C275 PolarHBondContact O-N 3.21Å; Y273-S276 PolarHBondContact O-N 2.83Å; Y273-M277 WeakPolarHBondContact O-CG 3.05Å; Y273-M277 PolarHBondContact O-N 3.46Å; Y273-H385 HydrophobicContact CD2-CB 4.11Å; Y273-H385 HydrophobicContact CE2-CB 3.64Å; Y273-H385 PolarHBondContact OH-N 2.98Å; Y273-F388 HydrophobicContact CD1-CB 3.96Å; Y273-F388 AromaticContact CD1-CD1 3.65Å; Y273-F388 HydrophobicContact CD1-CD1 3.65Å; Y273-F388 AromaticContact CD1-CD2 3.71Å; Y273-F388 HydrophobicContact CD1-CD2 3.71Å; Y273-F388 HydrophobicContact CD1-CE1 4.06Å; Y273-F388 HydrophobicContact CD1-CE2 4.13Å; Y273-F388 AromaticContact CD1-CG 3.47Å; Y273-F388 HydrophobicContact CD1-CG 3.47Å; Y273-F388 VanDerWaalsContact CD1-CG 3.47Å; Y273-F388 HydrophobicContact CD1-CZ 4.29Å; Y273-F388 HydrophobicContact CD2-CD2 4.28Å; Y273-F388 HydrophobicContact CE1-CB 3.48Å; Y273-F388 VanDerWaalsContact CE1-CB 3.48Å; Y273-F388 HydrophobicContact CE1-CD1 4.06Å; Y273-F388 AromaticContact CE1-CD2 3.97Å; Y273-F388 HydrophobicContact CE1-CD2 3.97Å; Y273-F388 AromaticContact CE1-CG 3.56Å; Y273-F388 HydrophobicContact CE1-CG 3.56Å; Y273-F388 HydrophobicContact CG-CD1 4.43Å; Y273-F388 AromaticContact CG-CD2 3.88Å; Y273-F388 HydrophobicContact CG-CD2 3.88Å; Y273-F388 AromaticContact CG-CE2 3.99Å; Y273-F388 HydrophobicContact CG-CE2 3.99Å; Y273-F388 HydrophobicContact CG-CG 4.13Å; Y273-F388 HydrophobicContact CG-CZ 4.31Å
274	V	96.1	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.6	-43.3	176.4	175.1	0	0	0	0	111.3	L197 L200 F240 Y270 I271 G272 S276 M277 V278	L197-V274 HydrophobicContact CD1-CG2 3.89Å; L200-V274 HydrophobicContact CD2-CG2 3.64Å; L200-V274 HydrophobicContact CG-CG2 3.87Å; F240-V274 HydrophobicContact CB-CG1 4.24Å; F240-V274 HydrophobicContact CD2-CG1 4Å; Y270-V274 PolarHBondContact O-N 3.17Å; Y270-V274 VanDerWaalsContact O-N 3.16Å; I271-V274 PolarHBondContact O-N 3.05Å; G272-V274 PolarHBondContact O-N 3.13Å; V274-S276 PolarHBondContact O-N 2.58Å; V274-M277 PolarHBondContact O-N 3.27Å; V274-V278 PolarHBondContact O-N 3.49Å; V274-V278 VanDerWaalsContact O-N 3.11Å
275	C	94.3	Very high	93.1	Very high	11 Å²	11	37.1 Å²	37.1	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-60.2	-44	178.2	-163.8	0	0	0	0	112.3	C239 S245 I271 G272 Y273 M277 S279	C239-C275 HydrophobicContact CB-CB 3.78Å; S245-C275 PolarHBondContact O-SG 2.59Å; I271-C275 WeakPolarHBondContact O-CB 3.3Å; I271-C275 PolarHBondContact O-N 3.09Å; G272-C275 WeakPolarHBondContact O-CB 3.21Å; G272-C275 PolarHBondContact O-N 3.05Å; Y273-C275 VanDerWaalsContact C-N 3.3Å; Y273-C275 PolarHBondContact O-N 3.21Å; C275-M277 VanDerWaalsContact C-N 3.35Å; C275-S279 WeakPolarHBondContact O-CB 3.31Å; C275-S279 PolarHBondContact O-N 2.78Å; C275-S279 VanDerWaalsContact O-N 3.17Å
276	S	93.2	Very high	93	Very high	36 Å²	36	38 Å²	38	25%	0.252	20%	0.201	S	C	.	.	H	α-helix	trans	-65.9	-34.3	175.2	-61.7	0	0	0	0	113.2	G272 Y273 V274 S279 T283	G272-S276 PolarHBondContact O-N 2.8Å; G272-S276 PolarHBondContact O-OG 3.06Å; Y273-S276 PolarHBondContact O-N 2.83Å; V274-S276 PolarHBondContact O-N 2.58Å; S276-S279 PolarHBondContact O-OG 2.81Å; S276-T283 PolarHBondContact O-N 3.18Å
277	M	92.9	Very high	92.7	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.015	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-30.3	-179.9	-68.5	159.9	67.4	0	0	113.9	L197 F201 Y273 V274 C275 P282 T283 F388 W437	L197-M277 HydrophobicContact CD1-SD 3.95Å; L197-M277 HydrophobicContact CD2-CE 4.4Å; L197-M277 HydrophobicContact CD2-SD 3.82Å; L197-M277 HydrophobicContact CG-CE 4.49Å; L197-M277 HydrophobicContact CG-SD 4.15Å; F201-M277 HydrophobicContact CD2-CE 3.54Å; F201-M277 HydrophobicContact CD2-SD 4.49Å; F201-M277 HydrophobicContact CE2-CB 4.26Å; F201-M277 HydrophobicContact CE2-CE 3.88Å; F201-M277 HydrophobicContact CG-CE 4.22Å; Y273-M277 WeakPolarHBondContact O-CG 3.05Å; Y273-M277 PolarHBondContact O-N 3.46Å; V274-M277 PolarHBondContact O-N 3.27Å; C275-M277 VanDerWaalsContact C-N 3.35Å; M277-P282 WeakPolarHBondContact O-CB 3.42Å; M277-T283 WeakPolarHBondContact CG-O 3.44Å; M277-F388 HydrophobicContact CG-CE1 4.47Å; M277-F388 HydrophobicContact CG-CZ 3.7Å; M277-F388 HydrophobicContact SD-CE2 4.22Å; M277-F388 HydrophobicContact SD-CZ 3.77Å; M277-W437 HydrophobicContact CE-CB 3.74Å; M277-W437 HydrophobicContact CE-CD2 3.26Å; M277-W437 HydrophobicContact CE-CE3 3.25Å; M277-W437 HydrophobicContact CE-CG 3.52Å; M277-W437 HydrophobicContact CE-CH2 4.49Å; M277-W437 HydrophobicContact CE-CZ3 3.89Å
278	V	92.4	Very high	92.7	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-89.7	-21.9	176.3	-60.4	0	0	0	0	113.7	F201 C239 F240 H242 V274 L445	F201-V278 HydrophobicContact CE2-CG1 4.16Å; C239-V278 WeakPolarHBondContact O-CG2 3.46Å; F240-V278 HydrophobicContact CD2-CG1 3.62Å; F240-V278 HydrophobicContact CE2-CG1 4.02Å; F240-V278 HydrophobicContact CG-CG1 4.16Å; H242-V278 PolarHBondContact CE1-O 3.39Å; V274-V278 PolarHBondContact O-N 3.49Å; V274-V278 VanDerWaalsContact O-N 3.11Å; V278-L445 HydrophobicContact CB-CD1 3.89Å; V278-L445 HydrophobicContact CG1-CD1 4.06Å
279	S	89.7	Confident	92.7	Very high	37 Å²	37	40.5 Å²	40.5	26%	0.259	21%	0.213	S	C	.	.	S	Bend	trans	-51	159.8	-174.2	71.3	0	0	0	0	114.6	C275 S276 K281 P282	C275-S279 WeakPolarHBondContact O-CB 3.31Å; C275-S279 PolarHBondContact O-N 2.78Å; C275-S279 VanDerWaalsContact O-N 3.17Å; S276-S279 PolarHBondContact O-OG 2.81Å; S279-K281 CarbonylContact O-C 3.22Å; S279-K281 PolarHBondContact O-N 3.22Å; S279-K281 PolarHBondContact OG-O 3.2Å; S279-P282 WeakPolarHBondContact O-CD 3.36Å; S279-P282 VanDerWaalsContact O-CG 3.3Å; S279-P282 WeakPolarHBondContact O-CG 3.43Å
280	E	84.6	Confident	92.7	Very high	204 Å²	204	39.1 Å²	39.1	95%	0.953	21%	0.208	S	C	*	.	S	Bend	trans	-50.1	-29.7	-177.8	-63	177.4	-178.3	0	0	114.4
281	K	86.4	Confident	92.7	Very high	138 Å²	138	40.9 Å²	40.9	60%	0.6	22%	0.219	S	C	*	.	S	Bend	trans	-118.6	84.3	169.8	-170.5	-174.9	-177.4	-172.3	0	109.3	S279 T283 Y490	S279-K281 CarbonylContact O-C 3.22Å; S279-K281 PolarHBondContact O-N 3.22Å; S279-K281 PolarHBondContact OG-O 3.2Å; K281-T283 PolarHBondContact O-N 2.91Å; K281-Y490 PolarHBondContact NZ-OH 2.89Å
282	P	88.1	Confident	92.8	Very high	62 Å²	62	40.9 Å²	40.9	40%	0.403	22%	0.219	S	C	.	.			trans	-56.7	120.2	-172	-30.3	37.7	0	0	0	114.2	M277 S279 L284	M277-P282 WeakPolarHBondContact O-CB 3.42Å; S279-P282 WeakPolarHBondContact O-CD 3.36Å; S279-P282 VanDerWaalsContact O-CG 3.3Å; S279-P282 WeakPolarHBondContact O-CG 3.43Å; P282-L284 HydrophobicContact CB-CD2 4.34Å; P282-L284 HydrophobicContact CB-CG 4.47Å; P282-L284 PolarHBondContact O-N 2.88Å
283	T	90.6	Very high	92.9	Very high	78 Å²	78	43.5 Å²	43.5	48%	0.479	23%	0.227	S	C	.	.			trans	-87.2	101	165.7	-58.6	0	0	0	0	108.7	S276 M277 K281 F388	S276-T283 PolarHBondContact O-N 3.18Å; M277-T283 WeakPolarHBondContact CG-O 3.44Å; K281-T283 PolarHBondContact O-N 2.91Å; T283-F388 HydrophobicContact CG2-CD1 4.44Å; T283-F388 HydrophobicContact CG2-CE1 4.13Å
284	L	90.9	Very high	93	Very high	95 Å²	95	43.5 Å²	43.5	50%	0.497	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-88.6	140.9	176.7	-60.1	-177.7	0	0	0	111.3	P282	P282-L284 HydrophobicContact CB-CD2 4.34Å; P282-L284 HydrophobicContact CB-CG 4.47Å; P282-L284 PolarHBondContact O-N 2.88Å
285	P	92.9	Very high	93.1	Very high	14 Å²	14	43.5 Å²	43.5	9%	0.091	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-70.3	139.5	179.3	24.8	-32.1	0	0	0	113.2	G387 F388 W437	P285-G387 VanDerWaalsContact CA-O 3.26Å; P285-G387 WeakPolarHBondContact CA-O 3.37Å; P285-F388 HydrophobicContact CB-CD2 4.03Å; P285-F388 HydrophobicContact CB-CE2 3.64Å; P285-F388 HydrophobicContact CB-CZ 4.27Å; P285-F388 HydrophobicContact CG-CE2 3.94Å; P285-F388 HydrophobicContact CG-CZ 4.37Å; P285-W437 HydrophobicContact CG-CH2 4.32Å; P285-W437 HydrophobicContact CG-CZ2 3.41Å; P285-W437 VanDerWaalsContact CG-CZ2 3.41Å
286	H	92.2	Very high	93.3	Very high	45 Å²	45	44.4 Å²	44.4	21%	0.208	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-78.9	163.7	172.4	62.1	75.2	0	0	0	113.2	K288 T386 G387 I389	H286-K288 WeakPolarHBondContact ND1-CB 3.36Å; H286-K288 PolarHBondContact ND1-N 3.22Å; H286-K288 PolarHBondContact ND1-O 2.74Å; H286-T386 PolarHBondContact CE1-O 3.42Å; H286-T386 PolarHBondContact NE2-O 2.83Å; H286-G387 PolarHBondContact CD2-O 2.88Å; H286-G387 PolarHBondContact N-O 2.95Å; H286-G387 VanDerWaalsContact N-O 3.15Å; H286-G387 VanDerWaalsContact O-CA 3.3Å; H286-G387 WeakPolarHBondContact O-CA 3.39Å; H286-I389 PolarHBondContact NE2-O 3.32Å
287	S	91.6	Very high	93.5	Very high	18 Å²	18	42.7 Å²	42.7	13%	0.126	22%	0.223	C	C	.	.			trans	-96.2	-5.9	178.8	19.9	0	0	0	0	114	Q352 D428 K431	S287-Q352 PolarHBondContact O-NE2 3.26Å; S287-Q352 VanDerWaalsContact O-NE2 3.12Å; S287-D428 VanDerWaalsContact CA-OD1 3.23Å; S287-D428 WeakPolarHBondContact CA-OD1 3.5Å; S287-D428 WeakPolarHBondContact CB-OD1 3.47Å; S287-D428 PolarHBondContact N-OD1 3.21Å; S287-D428 PolarHBondContact OG-OD1 2.77Å; S287-K431 WeakPolarHBondContact OG-CE 3.32Å
288	K	92.9	Very high	93.8	Very high	52 Å²	52	44 Å²	44	23%	0.226	23%	0.232	C	C	.	.			trans	-56.1	129.1	174.6	-52.8	-168.2	179.3	-145.6	0	111.9	H286 P391 V424 E425 G426 D428	H286-K288 WeakPolarHBondContact ND1-CB 3.36Å; H286-K288 PolarHBondContact ND1-N 3.22Å; H286-K288 PolarHBondContact ND1-O 2.74Å; K288-P391 HydrophobicContact CD-CG 4.46Å; K288-V424 HydrophobicContact CB-CG1 3.83Å; K288-V424 HydrophobicContact CD-CG1 4.33Å; K288-E425 WeakPolarHBondContact CD-O 3.27Å; K288-G426 PolarHBondContact NZ-O 2.86Å; K288-D428 VanDerWaalsContact CE-OD2 3.26Å; K288-D428 WeakPolarHBondContact CE-OD2 3.14Å; K288-D428 WeakPolarHBondContact CG-OD1 3.48Å; K288-D428 WeakPolarHBondContact CG-OD2 3.42Å; K288-D428 PolarHBondContact N-OD1 3.32Å
289	P	94.3	Very high	94	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.			trans	-67.6	166.4	172.6	-18.5	31.1	0	0	0	112.8	V351 E425 V427 K429	P289-V351 CarbonylContact C-O 3.53Å; P289-V351 WeakPolarHBondContact CA-O 3.43Å; P289-E425 HydrophobicContact CB-CB 4.36Å; P289-E425 HydrophobicContact CB-CG 4.22Å; P289-E425 HydrophobicContact CG-CB 4.48Å; P289-E425 WeakPolarHBondContact CG-OE2 3.26Å; P289-E425 PolarHBondContact O-N 2.83Å; P289-V427 VanDerWaalsContact CD-O 3.29Å; P289-V427 WeakPolarHBondContact CD-O 3.45Å; P289-K429 HydrophobicContact CB-CD 4.49Å; P289-K429 HydrophobicContact CG-CB 4.1Å; P289-K429 HydrophobicContact CG-CD 3.48Å; P289-K429 VanDerWaalsContact CG-CD 3.48Å; P289-K429 VanDerWaalsContact CG-CE 3.48Å; P289-K429 HydrophobicContact CG-CG 3.55Å
290	L	96.9	Very high	94.4	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.4	175.8	-172.4	80.3	0	0	0	108.8	I292 V351 F384 T386 I389 V422 E423 V424	L290-I292 HydrophobicContact CD2-CG1 4.43Å; L290-V351 HydrophobicContact CB-CG2 4.23Å; L290-V351 PolarHBondContact N-O 2.83Å; L290-V351 VanDerWaalsContact O-CG2 3.27Å; L290-V351 WeakPolarHBondContact O-CG2 3.28Å; L290-V351 PolarHBondContact O-N 3.48Å; L290-F384 HydrophobicContact CD2-CE2 3.63Å; L290-F384 HydrophobicContact CD2-CZ 4.11Å; L290-T386 HydrophobicContact CB-CG2 3.81Å; L290-T386 HydrophobicContact CD2-CG2 4.35Å; L290-I389 HydrophobicContact CD1-CB 4.41Å; L290-I389 HydrophobicContact CD1-CG2 3.94Å; L290-V422 HydrophobicContact CD1-CB 4.01Å; L290-V422 HydrophobicContact CD1-CG2 4.27Å; L290-V422 HydrophobicContact CD2-CB 4.41Å; L290-V422 HydrophobicContact CD2-CG1 4.19Å; L290-V422 HydrophobicContact CG-CB 4.23Å; L290-V422 HydrophobicContact CG-CG1 4.48Å; L290-E423 CarbonylContact C-O 3.56Å; L290-E423 WeakPolarHBondContact CA-O 3.36Å; L290-V424 HydrophobicContact CD1-CB 4.43Å; L290-V424 HydrophobicContact CD1-CG2 3.59Å
291	V	97.6	Very high	95	Very high	36 Å²	36	34.6 Å²	34.6	22%	0.218	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123.6	166.8	-177.8	0	0	0	0	108.5	K293 V349 V422 E423 E425	V291-K293 HydrophobicContact CG1-CG 4.28Å; V291-V349 CarbonylContact C-O 3.44Å; V291-V349 WeakPolarHBondContact CA-O 3.34Å; V291-V422 CarbonylContact O-C 3.47Å; V291-V422 WeakPolarHBondContact O-CA 3.4Å; V291-E423 HydrophobicContact CB-CB 4.46Å; V291-E423 PolarHBondContact N-O 2.89Å; V291-E423 PolarHBondContact O-N 3.18Å; V291-E425 HydrophobicContact CG2-CG 3.95Å; V291-E425 WeakPolarHBondContact CG2-OE1 3.45Å
292	I	98.3	Very high	95.5	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	105.2	166.9	-50.2	175.1	0	0	0	107.3	L290 V316 L347 G348 V349 V351 V355 V357 F384 L420 V422	L290-I292 HydrophobicContact CD2-CG1 4.43Å; I292-V316 HydrophobicContact CD1-CG1 4.41Å; I292-L347 HydrophobicContact CG2-CD1 3.8Å; I292-G348 WeakPolarHBondContact O-CA 3.21Å; I292-G348 PolarHBondContact O-N 3.15Å; I292-V349 HydrophobicContact CB-CG2 4.01Å; I292-V349 HydrophobicContact CD1-CG2 4.48Å; I292-V349 PolarHBondContact N-O 2.96Å; I292-V349 PolarHBondContact O-N 3.3Å; I292-V351 HydrophobicContact CD1-CG2 3.98Å; I292-V351 HydrophobicContact CG1-CG2 4.08Å; I292-V355 HydrophobicContact CD1-CG1 4.22Å; I292-V357 HydrophobicContact CD1-CG2 4.17Å; I292-F384 HydrophobicContact CD1-CZ 4.2Å; I292-L420 HydrophobicContact CG2-CB 4.47Å; I292-L420 HydrophobicContact CG2-CD2 4.46Å; I292-V422 HydrophobicContact CG1-CG1 4.39Å; I292-V422 HydrophobicContact CG2-CG1 4.44Å
293	K	98.3	Very high	95.9	Very high	68 Å²	68	26.7 Å²	26.7	30%	0.296	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-51.4	-178.1	-68.7	163.1	176.7	163.5	0	110.8	V291 L347 G348 D421 E423	V291-K293 HydrophobicContact CG1-CG 4.28Å; K293-L347 PolarHBondContact O-N 3.35Å; K293-G348 PolarHBondContact O-N 2.54Å; K293-G348 VanDerWaalsContact O-N 3.11Å; K293-D421 HydrophobicContact CB-CB 4.21Å; K293-D421 VanDerWaalsContact CB-OD2 3.28Å; K293-D421 WeakPolarHBondContact CB-OD2 3.49Å; K293-D421 WeakPolarHBondContact CD-OD1 3.47Å; K293-D421 WeakPolarHBondContact CD-OD2 3.39Å; K293-D421 PolarHBondContact N-O 2.84Å; K293-E423 WeakPolarHBondContact CE-OE2 3.47Å; K293-E423 IonicContact NZ-OE2 3.5Å; K293-E423 PolarHBondContact NZ-OE2 3.16Å
294	A	98.5	Very high	96	Very high	15 Å²	15	23.3 Å²	23.3	12%	0.124	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.7	-179.8	0	0	0	0	0	112.9	V344 F345 L420 D421	A294-V344 HydrophobicContact CB-CG1 4.33Å; A294-F345 CarbonylContact C-O 3.51Å; A294-F345 WeakPolarHBondContact CA-O 3.4Å; A294-F345 WeakPolarHBondContact CB-O 3.19Å; A294-L420 WeakPolarHBondContact O-CA 3.41Å; A294-D421 HydrophobicContact CB-CB 4.36Å; A294-D421 PolarHBondContact N-O 2.9Å; A294-D421 PolarHBondContact O-N 3.41Å
295	L	98.6	Very high	96	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	133.4	164	-177.7	153.8	0	0	0	109.4	M297 V344 F345 L347 V357 V359 F380 V418 I419 L420	L295-M297 HydrophobicContact CD2-CB 4.5Å; L295-V344 CarbonylContact O-C 3.49Å; L295-V344 WeakPolarHBondContact O-CA 3.44Å; L295-F345 HydrophobicContact CB-CD2 4.17Å; L295-F345 HydrophobicContact CD2-CD2 3.54Å; L295-F345 HydrophobicContact CD2-CE2 3.7Å; L295-F345 HydrophobicContact CG-CD2 4.41Å; L295-F345 PolarHBondContact N-O 3.08Å; L295-F345 PolarHBondContact O-N 2.87Å; L295-L347 HydrophobicContact CB-CD1 3.96Å; L295-V357 HydrophobicContact CD1-CG1 3.63Å; L295-V359 HydrophobicContact CD1-CG2 4.06Å; L295-V359 HydrophobicContact CD2-CG2 4.36Å; L295-F380 HydrophobicContact CD1-CE2 4.22Å; L295-F380 HydrophobicContact CD1-CZ 4.09Å; L295-F380 HydrophobicContact CD2-CZ 4.19Å; L295-V418 HydrophobicContact CD1-CG1 3.96Å; L295-V418 HydrophobicContact CD2-CG1 4.07Å; L295-V418 HydrophobicContact CG-CG1 3.86Å; L295-I419 CarbonylContact C-O 3.43Å; L295-I419 WeakPolarHBondContact CA-O 3.21Å; L295-L420 HydrophobicContact CB-CD2 3.93Å; L295-L420 HydrophobicContact CD1-CD2 3.69Å; L295-L420 HydrophobicContact CG-CD2 3.82Å
296	T	98.6	Very high	95.9	Very high	30 Å²	30	32.8 Å²	32.8	18%	0.184	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.1	168.3	-60.7	0	0	0	0	109.9	K342 V343 V344 V418 I419	T296-K342 HydrophobicContact CG2-CB 4.28Å; T296-K342 HydrophobicContact CG2-CD 4.08Å; T296-V343 CarbonylContact C-O 3.56Å; T296-V343 VanDerWaalsContact CA-O 3.29Å; T296-V343 WeakPolarHBondContact CA-O 3.28Å; T296-V344 HydrophobicContact CG2-CG2 4.15Å; T296-V418 CarbonylContact O-C 3.54Å; T296-V418 WeakPolarHBondContact O-CA 3.42Å; T296-I419 PolarHBondContact N-O 3.01Å; T296-I419 PolarHBondContact O-N 2.89Å
297	M	97.9	Very high	96	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.3	166.4	92.9	-176.2	83.8	0	0	110.2	L295 P301 P312 K342 V343 F345 V359 F380 F416	L295-M297 HydrophobicContact CD2-CB 4.5Å; M297-P301 VanDerWaalsContact SD-CD 3.52Å; M297-P301 HydrophobicContact SD-CG 3.75Å; M297-P312 HydrophobicContact CE-CB 3.92Å; M297-P312 HydrophobicContact CE-CG 3.99Å; M297-K342 WeakPolarHBondContact O-CA 3.43Å; M297-K342 WeakPolarHBondContact O-CB 3.46Å; M297-V343 HydrophobicContact CE-CB 3.89Å; M297-V343 HydrophobicContact CE-CG1 4.36Å; M297-V343 HydrophobicContact CE-CG2 4.07Å; M297-V343 HydrophobicContact CG-CB 4.23Å; M297-V343 HydrophobicContact CG-CG2 4.33Å; M297-V343 PolarHBondContact N-O 2.84Å; M297-V343 PolarHBondContact O-N 2.87Å; M297-V343 VanDerWaalsContact O-N 3.07Å; M297-V343 HydrophobicContact SD-CG2 4.47Å; M297-F345 HydrophobicContact CE-CE2 3.52Å; M297-F345 HydrophobicContact CE-CZ 3.68Å; M297-V359 HydrophobicContact CE-CG1 3.87Å; M297-F380 HydrophobicContact CB-CE1 4.36Å; M297-F380 HydrophobicContact SD-CE1 4.5Å; M297-F416 HydrophobicContact CB-CE2 4.12Å; M297-F416 HydrophobicContact CB-CZ 4.15Å; M297-F416 HydrophobicContact CG-CE2 4.1Å; M297-F416 HydrophobicContact CG-CZ 4.42Å; M297-F416 HydrophobicContact SD-CE2 4.32Å; M297-F416 HydrophobicContact SD-CZ 4.35Å
298	S	97.7	Very high	96.2	Very high	29 Å²	29	37.8 Å²	37.8	20%	0.203	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	139.7	-177.2	-172.3	0	0	0	0	112.5	F416 H417	S298-F416 WeakPolarHBondContact O-CA 3.3Å; S298-H417 PolarHBondContact N-O 3.48Å; S298-H417 PolarHBondContact O-CE1 3.4Å; S298-H417 PolarHBondContact O-N 2.81Å; S298-H417 PolarHBondContact O-ND1 2.96Å; S298-H417 VanDerWaalsContact O-ND1 3.11Å
299	P	97.9	Very high	96.3	Very high	44 Å²	44	35.3 Å²	35.3	29%	0.286	18%	0.176	S	C	.	.	S	Bend	cis	-68.3	177	-13.5	-16.1	29.7	0	0	0	112.4	G341 P413 F416	P299-G341 CarbonylContact C-O 3.52Å; P299-G341 WeakPolarHBondContact CA-O 3.45Å; P299-P413 HydrophobicContact CB-CB 3.97Å; P299-P413 HydrophobicContact CB-CG 3.67Å; P299-P413 HydrophobicContact CG-CB 4.05Å; P299-P413 HydrophobicContact CG-CG 3.98Å; P299-F416 WeakPolarHBondContact O-CD2 3.04Å; P299-F416 VanDerWaalsContact O-CE2 3.3Å; P299-F416 WeakPolarHBondContact O-CE2 3.08Å
300	I	98.1	Very high	96.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.176	C	C	.	.			trans	-71.5	130.1	-177.4	-68.2	162.8	0	0	0	111.7	H336 R337 E340 G341 V343	I300-H336 HydrophobicContact CD1-CB 4.25Å; I300-R337 WeakPolarHBondContact CD1-O 3.44Å; I300-E340 HydrophobicContact CD1-CB 3.64Å; I300-G341 PolarHBondContact N-O 2.8Å; I300-V343 HydrophobicContact CD1-CG2 4.32Å; I300-V343 HydrophobicContact CG1-CG2 3.92Å
301	P	97.4	Very high	96.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.			trans	-85.2	156.5	-179.5	35	-34.9	0	0	0	113.2	M297 F303 G309 C310 I379 K411 Y412 F416	M297-P301 VanDerWaalsContact SD-CD 3.52Å; M297-P301 HydrophobicContact SD-CG 3.75Å; P301-F303 HydrophobicContact CB-CD2 3.95Å; P301-F303 HydrophobicContact CB-CE2 4.02Å; P301-F303 HydrophobicContact CG-CD2 4.31Å; P301-F303 PolarHBondContact O-N 3.11Å; P301-G309 CarbonylContact O-C 3.58Å; P301-C310 WeakPolarHBondContact O-CB 3.48Å; P301-C310 PolarHBondContact O-N 3.08Å; P301-I379 HydrophobicContact CB-CG2 4.36Å; P301-I379 HydrophobicContact CG-CD1 4.42Å; P301-I379 HydrophobicContact CG-CG2 3.76Å; P301-K411 WeakPolarHBondContact CB-O 3.46Å; P301-Y412 HydrophobicContact CB-CD1 4.47Å; P301-F416 HydrophobicContact CB-CE2 4.28Å; P301-F416 HydrophobicContact CG-CE2 4.07Å; P301-F416 HydrophobicContact CG-CZ 4.39Å
302	C	96.3	Very high	96.6	Very high	20 Å²	20	35.6 Å²	35.6	14%	0.135	17%	0.173	C	C	.	.			trans	-103.8	59.1	-161.9	-63.5	0	0	0	0	113	R307 G309 K411	C302-R307 HydrophobicContact CB-CB 4.21Å; C302-R307 WeakPolarHBondContact CB-O 3.2Å; C302-R307 WeakPolarHBondContact O-CD 3.46Å; C302-R307 PolarHBondContact SG-O 3.05Å; C302-R307 VanDerWaalsContact SG-O 3.38Å; C302-G309 CarbonylContact C-O 3.54Å; C302-K411 PolarHBondContact N-O 2.83Å
303	F	96.7	Very high	96.6	Very high	14 Å²	14	36 Å²	36	6%	0.061	18%	0.175	C	C	.	.			trans	-86.2	-17.8	-174.5	-84.3	-107.3	0	0	0	115.3	P301 G309 C310 H361 T377 Q378 I379 D407 K411 Y412	P301-F303 HydrophobicContact CB-CD2 3.95Å; P301-F303 HydrophobicContact CB-CE2 4.02Å; P301-F303 HydrophobicContact CG-CD2 4.31Å; P301-F303 PolarHBondContact O-N 3.11Å; F303-G309 PolarHBondContact N-O 3.46Å; F303-C310 HydrophobicContact CB-CB 3.96Å; F303-H361 HydrophobicContact CB-CB 3.73Å; F303-H361 HydrophobicContact CD1-CB 4.15Å; F303-H361 HydrophobicContact CG-CB 4.19Å; F303-H361 PolarHBondContact O-CD2 3.47Å; F303-T377 HydrophobicContact CD1-CG2 4.28Å; F303-T377 HydrophobicContact CE1-CG2 4.2Å; F303-Q378 WeakPolarHBondContact CE1-O 3.43Å; F303-I379 HydrophobicContact CD1-CG1 4.13Å; F303-I379 HydrophobicContact CD2-CD1 4.38Å; F303-I379 HydrophobicContact CD2-CG1 4.18Å; F303-I379 HydrophobicContact CD2-CG2 4.24Å; F303-I379 HydrophobicContact CE1-CG1 4.15Å; F303-I379 HydrophobicContact CE2-CB 4.28Å; F303-I379 HydrophobicContact CE2-CG1 4.21Å; F303-I379 HydrophobicContact CE2-CG2 3.74Å; F303-I379 HydrophobicContact CG-CD1 4.42Å; F303-I379 HydrophobicContact CG-CG1 4.15Å; F303-I379 HydrophobicContact CZ-CB 4.19Å; F303-I379 HydrophobicContact CZ-CG1 4.19Å; F303-I379 HydrophobicContact CZ-CG2 4.07Å; F303-D407 HydrophobicContact CE1-CB 3.72Å; F303-D407 WeakPolarHBondContact CE1-OD2 3.21Å; F303-D407 HydrophobicContact CZ-CB 3.62Å; F303-K411 HydrophobicContact CD2-CB 4.21Å; F303-K411 HydrophobicContact CE1-CD 4.27Å; F303-K411 HydrophobicContact CE2-CB 3.81Å; F303-K411 HydrophobicContact CZ-CB 4.22Å; F303-K411 HydrophobicContact CZ-CD 4.24Å; F303-Y412 HydrophobicContact CE2-CE1 4.26Å; F303-Y412 HydrophobicContact CE2-CE2 4.22Å; F303-Y412 AromaticContact CE2-CZ 3.92Å; F303-Y412 HydrophobicContact CZ-CE1 4.49Å; F303-Y412 HydrophobicContact CZ-CE2 4.14Å; F303-Y412 AromaticContact CZ-CZ 3.79Å; F303-Y412 WeakPolarHBondContact CZ-OH 3.43Å
304	N	93.3	Very high	96.6	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.037	16%	0.161	C	C	.	.	S	Bend	trans	-69.3	168.2	179.2	78.5	4.6	0	0	0	112.1	Q306 R307 S308 G309 E335	N304-Q306 PolarHBondContact O-N 2.94Å; N304-Q306 VanDerWaalsContact O-N 3.16Å; N304-Q306 PolarHBondContact OD1-N 2.99Å; N304-R307 PolarHBondContact O-N 3.33Å; N304-R307 VanDerWaalsContact O-N 3.15Å; N304-R307 PolarHBondContact OD1-N 2.86Å; N304-S308 PolarHBondContact ND2-OG 2.88Å; N304-S308 PolarHBondContact OD1-N 2.95Å; N304-S308 PolarHBondContact OD1-OG 2.96Å; N304-G309 WeakPolarHBondContact CB-O 3.44Å; N304-G309 PolarHBondContact N-O 3.11Å; N304-E335 PolarHBondContact ND2-OE1 2.86Å
305	K	90.9	Very high	96.6	Very high	155 Å²	155	32.4 Å²	32.4	67%	0.674	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-31.1	-179.1	-75.6	-172.7	177	-176	0	113.2
306	Q	90.7	Very high	96.6	Very high	153 Å²	153	32.4 Å²	32.4	72%	0.715	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.6	-176.5	-68.7	177.4	-9.5	0	0	114	N304 S308	N304-Q306 PolarHBondContact O-N 2.94Å; N304-Q306 VanDerWaalsContact O-N 3.16Å; N304-Q306 PolarHBondContact OD1-N 2.99Å; Q306-S308 WeakPolarHBondContact CB-OG 3.47Å; Q306-S308 PolarHBondContact O-N 2.56Å; Q306-S308 PolarHBondContact OE1-OG 2.98Å
307	R	93.6	Very high	96.5	Very high	136 Å²	136	32 Å²	32	51%	0.513	15%	0.154	S	C	.	.	S	Bend	trans	53.2	29.4	-168.5	-59.2	-64.1	-168.6	-84.8	-7.7	113.4	C302 N304	C302-R307 HydrophobicContact CB-CB 4.21Å; C302-R307 WeakPolarHBondContact CB-O 3.2Å; C302-R307 WeakPolarHBondContact O-CD 3.46Å; C302-R307 PolarHBondContact SG-O 3.05Å; C302-R307 VanDerWaalsContact SG-O 3.38Å; N304-R307 PolarHBondContact O-N 3.33Å; N304-R307 VanDerWaalsContact O-N 3.15Å; N304-R307 PolarHBondContact OD1-N 2.86Å
308	S	94.9	Very high	96.4	Very high	33 Å²	33	34.9 Å²	34.9	23%	0.231	17%	0.168	C	C	.	.	S	Bend	trans	-106.1	-0.3	-174.7	62.1	0	0	0	0	114.3	N304 Q306 R337 I338	N304-S308 PolarHBondContact ND2-OG 2.88Å; N304-S308 PolarHBondContact OD1-N 2.95Å; N304-S308 PolarHBondContact OD1-OG 2.96Å; Q306-S308 WeakPolarHBondContact CB-OG 3.47Å; Q306-S308 PolarHBondContact O-N 2.56Å; Q306-S308 PolarHBondContact OE1-OG 2.98Å; S308-R337 WeakPolarHBondContact O-CA 3.39Å; S308-I338 WeakPolarHBondContact O-CG1 3.34Å; S308-I338 PolarHBondContact O-N 3.43Å; S308-I338 VanDerWaalsContact O-N 3.12Å
309	G	96.6	Very high	96.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.5	-160.9	-178.7	0	0	0	0	0	112.6	P301 C302 F303 N304 H336	P301-G309 CarbonylContact O-C 3.58Å; C302-G309 CarbonylContact C-O 3.54Å; F303-G309 PolarHBondContact N-O 3.46Å; N304-G309 WeakPolarHBondContact CB-O 3.44Å; N304-G309 PolarHBondContact N-O 3.11Å; G309-H336 CarbonylContact C-O 3.46Å; G309-H336 VanDerWaalsContact CA-O 3.22Å; G309-H336 WeakPolarHBondContact CA-O 3.17Å
310	C	97.5	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	164.4	176.8	64.5	0	0	0	0	112.1	P301 F303 P312 H336 I379	P301-C310 WeakPolarHBondContact O-CB 3.48Å; P301-C310 PolarHBondContact O-N 3.08Å; F303-C310 HydrophobicContact CB-CB 3.96Å; C310-P312 WeakPolarHBondContact O-CD 3.37Å; C310-H336 PolarHBondContact N-O 3.42Å; C310-H336 PolarHBondContact O-N 3.3Å; C310-I379 HydrophobicContact CB-CD1 4.28Å
311	R	97.9	Very high	95.6	Very high	38 Å²	38	42.3 Å²	42.3	14%	0.143	21%	0.208	C	C	.	.			trans	-117.7	85.8	171.8	-176.8	-179.1	-60.1	-139.2	-1.9	108.2	Y330 M333 R334 E335 H361 M362	R311-Y330 PolarHBondContact NH1-O 3.16Å; R311-M333 WeakPolarHBondContact CD-O 3.14Å; R311-M333 HydrophobicContact CG-CB 3.83Å; R311-M333 WeakPolarHBondContact CG-O 3.33Å; R311-M333 PolarHBondContact NH1-O 2.81Å; R311-R334 WeakPolarHBondContact CG-O 3.44Å; R311-E335 HydrophobicContact CB-CB 4.21Å; R311-E335 HydrophobicContact CB-CG 4.26Å; R311-E335 HydrophobicContact CG-CB 4.45Å; R311-E335 IonicContact CZ-OE2 3.53Å; R311-E335 IonicContact NE-OE2 3.42Å; R311-E335 PolarHBondContact NE-OE2 2.99Å; R311-E335 IonicContact NH2-OE2 2.75Å; R311-E335 PolarHBondContact NH2-OE2 2.83Å; R311-H361 PolarHBondContact N-ND1 2.92Å; R311-H361 VanDerWaalsContact N-ND1 3.13Å; R311-H361 CarbonylContact O-C 3.6Å; R311-H361 WeakPolarHBondContact O-CA 3.09Å; R311-H361 PolarHBondContact O-ND1 2.8Å; R311-M362 PolarHBondContact O-N 3Å
312	P	98.1	Very high	95.5	Very high	4 Å²	4	47.3 Å²	47.3	3%	0.026	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	148.4	-163.2	38.5	-33.6	0	0	0	113.3	M297 C310 M333 V343 F345 V359 Y360 I379	M297-P312 HydrophobicContact CE-CB 3.92Å; M297-P312 HydrophobicContact CE-CG 3.99Å; C310-P312 WeakPolarHBondContact O-CD 3.37Å; P312-M333 WeakPolarHBondContact O-CE 3.49Å; P312-V343 HydrophobicContact CG-CG1 4.12Å; P312-V343 HydrophobicContact CG-CG2 4.26Å; P312-F345 HydrophobicContact CB-CZ 3.98Å; P312-F345 HydrophobicContact CG-CE1 4.39Å; P312-F345 HydrophobicContact CG-CZ 3.88Å; P312-V359 HydrophobicContact CB-CG1 4.19Å; P312-Y360 CarbonylContact C-O 3.5Å; P312-Y360 VanDerWaalsContact CA-O 3.23Å; P312-Y360 WeakPolarHBondContact CA-O 3.38Å; P312-I379 HydrophobicContact CB-CD1 3.99Å
313	F	98.4	Very high	95.6	Very high	10 Å²	10	50 Å²	50	4%	0.044	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	158.2	162.9	66.4	-91	0	0	0	110.9	T326 A327 M333 V359 Y360 M362 N376	F313-T326 WeakPolarHBondContact CA-OG1 3.39Å; F313-A327 HydrophobicContact CB-CB 4.29Å; F313-A327 HydrophobicContact CD1-CB 4.48Å; F313-A327 HydrophobicContact CD2-CB 3.75Å; F313-A327 HydrophobicContact CE2-CB 4.13Å; F313-A327 HydrophobicContact CG-CB 3.94Å; F313-M333 HydrophobicContact CB-CE 3.75Å; F313-M333 HydrophobicContact CB-SD 4.4Å; F313-V359 VanDerWaalsContact O-CA 3.3Å; F313-V359 WeakPolarHBondContact O-CA 3.38Å; F313-Y360 WeakPolarHBondContact CD1-O 3.27Å; F313-Y360 HydrophobicContact CD2-CD2 4.16Å; F313-Y360 HydrophobicContact CE1-CG 4.47Å; F313-Y360 AromaticContact CE2-CD2 3.53Å; F313-Y360 HydrophobicContact CE2-CD2 3.53Å; F313-Y360 HydrophobicContact CE2-CE2 4.34Å; F313-Y360 HydrophobicContact CE2-CG 4.06Å; F313-Y360 AromaticContact CZ-CD2 3.84Å; F313-Y360 HydrophobicContact CZ-CD2 3.84Å; F313-Y360 AromaticContact CZ-CG 3.89Å; F313-Y360 HydrophobicContact CZ-CG 3.89Å; F313-Y360 PolarHBondContact N-O 2.86Å; F313-Y360 PolarHBondContact O-N 2.82Å; F313-M362 HydrophobicContact CD1-CB 4.19Å; F313-M362 HydrophobicContact CD1-CE 3.8Å; F313-M362 HydrophobicContact CE1-CB 4.18Å; F313-M362 HydrophobicContact CE1-CE 3.78Å; F313-N376 HydrophobicContact CE1-CB 4.02Å; F313-N376 HydrophobicContact CZ-CB 4.19Å
314	C	98.4	Very high	95.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.2	178.6	-173.8	0	0	0	0	110.6	T325 T326 F345 L347 S358 V359	C314-T325 CarbonylContact O-C 3.43Å; C314-T325 WeakPolarHBondContact O-CA 3.38Å; C314-T326 HydrophobicContact CB-CG2 4.09Å; C314-T326 PolarHBondContact N-OG1 2.91Å; C314-T326 PolarHBondContact O-N 2.81Å; C314-F345 HydrophobicContact CB-CD1 4.05Å; C314-F345 HydrophobicContact CB-CD2 4.35Å; C314-F345 HydrophobicContact CB-CE1 4.34Å; C314-F345 HydrophobicContact CB-CG 4.06Å; C314-L347 HydrophobicContact CB-CD2 4.38Å; C314-S358 CarbonylContact C-O 3.59Å; C314-S358 WeakPolarHBondContact CA-O 3.42Å; C314-V359 HydrophobicContact CB-CG2 4.14Å
315	D	98.3	Very high	95.9	Very high	6 Å²	6	54.9 Å²	54.9	3%	0.032	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	141.3	169.5	-74.2	-36.9	0	0	0	109.5	L317 K322 T325 S358 Y360	D315-L317 HydrophobicContact CB-CD1 4.31Å; D315-K322 HydrophobicContact CB-CD 4.33Å; D315-K322 VanDerWaalsContact CG-CE 3.47Å; D315-K322 IonicContact OD1-NZ 3.83Å; D315-K322 PolarHBondContact OD1-NZ 3.34Å; D315-K322 WeakPolarHBondContact OD2-CE 3.43Å; D315-K322 IonicContact OD2-NZ 3.76Å; D315-K322 PolarHBondContact OD2-NZ 3.41Å; D315-T325 WeakPolarHBondContact OD1-CB 3.27Å; D315-T325 PolarHBondContact OD1-OG1 2.89Å; D315-S358 PolarHBondContact N-O 2.79Å; D315-S358 PolarHBondContact O-N 3.38Å; D315-Y360 HydrophobicContact CB-CE2 4.24Å; D315-Y360 VanDerWaalsContact OD2-CE2 3.3Å; D315-Y360 WeakPolarHBondContact OD2-CE2 3.41Å
316	V	98.5	Very high	96.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.9	171.4	-173.1	0	0	0	0	109.4	I292 I323 F324 L347 V349 V351 V355 V357	I292-V316 HydrophobicContact CD1-CG1 4.41Å; V316-I323 HydrophobicContact CB-CG1 4.34Å; V316-I323 HydrophobicContact CG1-CD1 4.1Å; V316-I323 HydrophobicContact CG1-CG1 4.23Å; V316-I323 VanDerWaalsContact O-CG1 3.28Å; V316-I323 WeakPolarHBondContact O-CG1 3.33Å; V316-I323 PolarHBondContact O-N 3.38Å; V316-F324 HydrophobicContact CB-CB 4.29Å; V316-F324 HydrophobicContact CG2-CD1 4.5Å; V316-F324 PolarHBondContact N-O 2.91Å; V316-F324 PolarHBondContact O-N 2.92Å; V316-L347 HydrophobicContact CG2-CD1 4.27Å; V316-V349 HydrophobicContact CG1-CG2 4.34Å; V316-V349 HydrophobicContact CG2-CG2 4.36Å; V316-V351 HydrophobicContact CG1-CG1 4.24Å; V316-V355 HydrophobicContact CG1-CG1 4.3Å; V316-V357 HydrophobicContact CG1-CG2 4.43Å; V316-V357 HydrophobicContact CG2-CG1 4.46Å
317	L	97.8	Very high	96.5	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.12	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.6	-178.3	-46.8	88.3	0	0	0	110.8	D315 T321 K322 V356	D315-L317 HydrophobicContact CB-CD1 4.31Å; L317-T321 CarbonylContact C-O 3.55Å; L317-T321 WeakPolarHBondContact CA-O 3.33Å; L317-T321 WeakPolarHBondContact CB-O 3.47Å; L317-K322 HydrophobicContact CD2-CB 4.01Å; L317-K322 HydrophobicContact CG-CB 4Å; L317-K322 HydrophobicContact CG-CG 4.24Å; L317-V356 HydrophobicContact CB-CB 4.24Å; L317-V356 HydrophobicContact CD1-CB 4.1Å; L317-V356 HydrophobicContact CD1-CG1 4.19Å; L317-V356 PolarHBondContact N-O 2.68Å; L317-V356 PolarHBondContact O-N 3.28Å
318	I	95.5	Very high	96.6	Very high	59 Å²	59	41.4 Å²	41.4	30%	0.303	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.6	165.4	-61.1	178.1	0	0	0	107.2	E320 T321 I323 V351 D354	I318-E320 PolarHBondContact O-N 3.28Å; I318-T321 PolarHBondContact N-O 3.37Å; I318-T321 PolarHBondContact O-N 3.36Å; I318-I323 HydrophobicContact CD1-CD1 4.05Å; I318-I323 HydrophobicContact CD1-CG2 4.31Å; I318-I323 HydrophobicContact CG1-CD1 4.06Å; I318-I323 HydrophobicContact CG1-CG1 4.5Å; I318-I323 HydrophobicContact CG1-CG2 4.29Å; I318-V351 HydrophobicContact CD1-CB 4.12Å; I318-V351 HydrophobicContact CD1-CG1 4.23Å; I318-V351 HydrophobicContact CG1-CB 4.39Å; I318-V351 HydrophobicContact CG1-CG1 4.4Å; I318-D354 CarbonylContact C-O 3.55Å; I318-D354 WeakPolarHBondContact CA-O 3.26Å
319	G	91.3	Very high	96.6	Very high	20 Å²	20	46.6 Å²	46.6	21%	0.206	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-115.3	-166.1	0	0	0	0	0	111.3	Q193 D354	Q193-G319 PolarHBondContact NE2-O 3.01Å; G319-D354 PolarHBondContact N-O 3.17Å
320	E	90.7	Very high	96.4	Very high	112 Å²	112	49.4 Å²	49.4	52%	0.523	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.5	172.6	-64.2	179.2	108.7	0	0	113	Q172 P190 I318 K322	Q172-E320 PolarHBondContact NE2-OE1 2.89Å; P190-E320 HydrophobicContact CB-CG 4.44Å; I318-E320 PolarHBondContact O-N 3.28Å; E320-K322 PolarHBondContact O-N 2.71Å
321	T	94.4	Very high	96.2	Very high	98 Å²	98	57.8 Å²	57.8	60%	0.601	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	113.1	-174.2	-60.4	0	0	0	0	110.9	L317 I318 I323	L317-T321 CarbonylContact C-O 3.55Å; L317-T321 WeakPolarHBondContact CA-O 3.33Å; L317-T321 WeakPolarHBondContact CB-O 3.47Å; I318-T321 PolarHBondContact N-O 3.37Å; I318-T321 PolarHBondContact O-N 3.36Å; T321-I323 PolarHBondContact O-N 2.79Å
322	K	96.4	Very high	96	Very high	106 Å²	106	64.1 Å²	64.1	46%	0.461	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119	172.3	-170.8	-174.8	-60.6	-163.7	0	110.5	D315 L317 E320	D315-K322 HydrophobicContact CB-CD 4.33Å; D315-K322 VanDerWaalsContact CG-CE 3.47Å; D315-K322 IonicContact OD1-NZ 3.83Å; D315-K322 PolarHBondContact OD1-NZ 3.34Å; D315-K322 WeakPolarHBondContact OD2-CE 3.43Å; D315-K322 IonicContact OD2-NZ 3.76Å; D315-K322 PolarHBondContact OD2-NZ 3.41Å; L317-K322 HydrophobicContact CD2-CB 4.01Å; L317-K322 HydrophobicContact CG-CB 4Å; L317-K322 HydrophobicContact CG-CG 4.24Å; E320-K322 PolarHBondContact O-N 2.71Å
323	I	97.4	Very high	95.9	Very high	75 Å²	75	64.5 Å²	64.5	39%	0.385	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-23.5	179.6	57	156.9	0	0	0	112.9	V316 I318 T321 V351	V316-I323 HydrophobicContact CB-CG1 4.34Å; V316-I323 HydrophobicContact CG1-CD1 4.1Å; V316-I323 HydrophobicContact CG1-CG1 4.23Å; V316-I323 VanDerWaalsContact O-CG1 3.28Å; V316-I323 WeakPolarHBondContact O-CG1 3.33Å; V316-I323 PolarHBondContact O-N 3.38Å; I318-I323 HydrophobicContact CD1-CD1 4.05Å; I318-I323 HydrophobicContact CD1-CG2 4.31Å; I318-I323 HydrophobicContact CG1-CD1 4.06Å; I318-I323 HydrophobicContact CG1-CG1 4.5Å; I318-I323 HydrophobicContact CG1-CG2 4.29Å; T321-I323 PolarHBondContact O-N 2.79Å; I323-V351 HydrophobicContact CD1-CG1 3.45Å; I323-V351 VanDerWaalsContact CD1-CG1 3.45Å
324	F	98.2	Very high	95.7	Very high	66 Å²	66	71.5 Å²	71.5	29%	0.289	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151.4	-174.8	-173.9	-97.8	0	0	0	111.8	V316 T326 L347 V349	V316-F324 HydrophobicContact CB-CB 4.29Å; V316-F324 HydrophobicContact CG2-CD1 4.5Å; V316-F324 PolarHBondContact N-O 2.91Å; V316-F324 PolarHBondContact O-N 2.92Å; F324-T326 HydrophobicContact CE1-CG2 3.77Å; F324-L347 HydrophobicContact CD1-CD2 4.14Å; F324-L347 HydrophobicContact CE1-CB 4.48Å; F324-L347 HydrophobicContact CE1-CD2 3.64Å; F324-V349 HydrophobicContact CB-CG1 3.85Å; F324-V349 HydrophobicContact CD1-CG1 4.13Å; F324-V349 HydrophobicContact CD2-CG1 3.72Å; F324-V349 HydrophobicContact CE2-CG1 4.28Å; F324-V349 HydrophobicContact CG-CG1 3.64Å
325	T	98.1	Very high	95.6	Very high	58 Å²	58	74.7 Å²	74.7	36%	0.356	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	143.9	173	-171.2	0	0	0	0	111	C314 D315 A327	C314-T325 CarbonylContact O-C 3.43Å; C314-T325 WeakPolarHBondContact O-CA 3.38Å; D315-T325 WeakPolarHBondContact OD1-CB 3.27Å; D315-T325 PolarHBondContact OD1-OG1 2.89Å; T325-A327 VanDerWaalsContact C-N 3.34Å; T325-A327 HydrophobicContact CG2-CB 4.35Å; T325-A327 VanDerWaalsContact OG1-CB 3.26Å; T325-A327 WeakPolarHBondContact OG1-CB 3.09Å; T325-A327 PolarHBondContact OG1-N 2.93Å; T325-A327 VanDerWaalsContact OG1-N 3.1Å
326	T	98	Very high	95.5	Very high	30 Å²	30	75.6 Å²	75.6	18%	0.184	36%	0.363	C	S	.	.			trans	-94.3	8.1	167.1	79.4	0	0	0	0	112.3	F313 C314 F324 Q328 F345 L347	F313-T326 WeakPolarHBondContact CA-OG1 3.39Å; C314-T326 HydrophobicContact CB-CG2 4.09Å; C314-T326 PolarHBondContact N-OG1 2.91Å; C314-T326 PolarHBondContact O-N 2.81Å; F324-T326 HydrophobicContact CE1-CG2 3.77Å; T326-Q328 PolarHBondContact O-N 3.06Å; T326-F345 HydrophobicContact CG2-CB 4.4Å; T326-F345 HydrophobicContact CG2-CD1 4.18Å; T326-L347 HydrophobicContact CG2-CD2 3.81Å
327	A	97	Very high	95.4	Very high	40 Å²	40	82.7 Å²	82.7	33%	0.331	39%	0.39	S	S	.	.			trans	-65.9	131.5	-179.6	0	0	0	0	0	111.2	F313 T325	F313-A327 HydrophobicContact CB-CB 4.29Å; F313-A327 HydrophobicContact CD1-CB 4.48Å; F313-A327 HydrophobicContact CD2-CB 3.75Å; F313-A327 HydrophobicContact CE2-CB 4.13Å; F313-A327 HydrophobicContact CG-CB 3.94Å; T325-A327 VanDerWaalsContact C-N 3.34Å; T325-A327 HydrophobicContact CG2-CB 4.35Å; T325-A327 VanDerWaalsContact OG1-CB 3.26Å; T325-A327 WeakPolarHBondContact OG1-CB 3.09Å; T325-A327 PolarHBondContact OG1-N 2.93Å; T325-A327 VanDerWaalsContact OG1-N 3.1Å
328	Q	95.8	Very high	95.3	Very high	91 Å²	91	85.8 Å²	85.8	43%	0.425	41%	0.406	S	S	.	.			trans	-124.7	174.4	170.2	-65	-179.4	66.9	0	0	109.2	T326 R332 M333 M362	T326-Q328 PolarHBondContact O-N 3.06Å; Q328-R332 HydrophobicContact CB-CB 4.07Å; Q328-R332 VanDerWaalsContact OE1-CZ 3.32Å; Q328-M333 HydrophobicContact CB-CG 4.25Å; Q328-M333 HydrophobicContact CB-SD 3.83Å; Q328-M333 HydrophobicContact CG-SD 4.47Å; Q328-M333 PolarHBondContact N-SD 2.94Å; Q328-M333 WeakPolarHBondContact O-CG 3.39Å; Q328-M362 WeakPolarHBondContact O-CE 3.22Å
329	E	93.7	Very high	95.3	Very high	143 Å²	143	91.4 Å²	91.4	67%	0.668	43%	0.431	S	S	*	.			trans	-54	144.4	169.3	-174.3	162.6	-136.8	0	0	111.8	E331 R332 M333	E329-E331 PolarHBondContact O-N 2.84Å; E329-R332 WeakPolarHBondContact O-CA 3.27Å; E329-R332 WeakPolarHBondContact O-CB 3.43Å; E329-R332 PolarHBondContact O-N 2.79Å; E329-M333 PolarHBondContact O-N 2.93Å
330	Y	93.4	Very high	95.5	Very high	59 Å²	59	93.9 Å²	93.9	23%	0.231	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-33	-168	175.2	-99.9	0	0	0	114.4	R311 M362 S364 V374	R311-Y330 PolarHBondContact NH1-O 3.16Å; Y330-M362 HydrophobicContact CD2-CB 4.49Å; Y330-M362 HydrophobicContact CD2-CG 3.93Å; Y330-M362 HydrophobicContact CD2-SD 4Å; Y330-S364 VanDerWaalsContact CE2-N 3.27Å; Y330-V374 HydrophobicContact CD2-CG1 4.5Å; Y330-V374 HydrophobicContact CG-CG2 4.33Å
331	E	92.4	Very high	95.7	Very high	175 Å²	175	90.1 Å²	90.1	82%	0.818	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-27.8	179.7	-55.3	-168.9	165.4	0	0	112.5	E329	E329-E331 PolarHBondContact O-N 2.84Å
332	R	95.4	Very high	95.8	Very high	172 Å²	172	91.1 Å²	91.1	65%	0.649	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-19.4	174.6	-65.4	175.3	53.5	150	0.6	113	Q328 E329 R334	Q328-R332 HydrophobicContact CB-CB 4.07Å; Q328-R332 VanDerWaalsContact OE1-CZ 3.32Å; E329-R332 WeakPolarHBondContact O-CA 3.27Å; E329-R332 WeakPolarHBondContact O-CB 3.43Å; E329-R332 PolarHBondContact O-N 2.79Å; R332-R334 PolarHBondContact O-N 3.06Å
333	M	95.6	Very high	95.9	Very high	11 Å²	11	86.1 Å²	86.1	5%	0.054	40%	0.403	C	S	.	.	S	Bend	trans	-71.5	112.6	178.1	-76.4	-58.4	-49.6	0	0	111.7	R311 P312 F313 Q328 E329 E335 M362	R311-M333 WeakPolarHBondContact CD-O 3.14Å; R311-M333 HydrophobicContact CG-CB 3.83Å; R311-M333 WeakPolarHBondContact CG-O 3.33Å; R311-M333 PolarHBondContact NH1-O 2.81Å; P312-M333 WeakPolarHBondContact O-CE 3.49Å; F313-M333 HydrophobicContact CB-CE 3.75Å; F313-M333 HydrophobicContact CB-SD 4.4Å; Q328-M333 HydrophobicContact CB-CG 4.25Å; Q328-M333 HydrophobicContact CB-SD 3.83Å; Q328-M333 HydrophobicContact CG-SD 4.47Å; Q328-M333 PolarHBondContact N-SD 2.94Å; Q328-M333 WeakPolarHBondContact O-CG 3.39Å; E329-M333 PolarHBondContact O-N 2.93Å; M333-E335 PolarHBondContact O-N 3.25Å; M333-M362 HydrophobicContact CG-CE 3.95Å; M333-M362 HydrophobicContact CG-SD 3.95Å
334	R	94.3	Very high	95.9	Very high	158 Å²	158	85.9 Å²	85.9	60%	0.596	41%	0.405	S	S	*	.			trans	-62	131.6	176.8	178.3	172.3	172.1	168.4	-5.8	111.7	R311 R332 H336 E340	R311-R334 WeakPolarHBondContact CG-O 3.44Å; R332-R334 PolarHBondContact O-N 3.06Å; R334-H336 VanDerWaalsContact CD-CE1 3.48Å; R334-H336 WeakPolarHBondContact CD-CE1 3.48Å; R334-H336 WeakPolarHBondContact CD-NE2 3.32Å; R334-H336 PolarHBondContact NE-CE1 2.93Å; R334-E340 IonicContact CZ-OE2 3.88Å; R334-E340 IonicContact NE-OE2 3.15Å; R334-E340 IonicContact NH2-OE2 3.09Å; R334-E340 PolarHBondContact NH2-OE2 2.8Å
335	E	95.5	Very high	95.9	Very high	66 Å²	66	83.5 Å²	83.5	31%	0.308	39%	0.394	S	S	.	.			trans	-90.2	135.7	165.9	-169.2	160.2	168.7	0	0	109.7	N304 R311 M333	N304-E335 PolarHBondContact ND2-OE1 2.86Å; R311-E335 HydrophobicContact CB-CB 4.21Å; R311-E335 HydrophobicContact CB-CG 4.26Å; R311-E335 HydrophobicContact CG-CB 4.45Å; R311-E335 IonicContact CZ-OE2 3.53Å; R311-E335 IonicContact NE-OE2 3.42Å; R311-E335 PolarHBondContact NE-OE2 2.99Å; R311-E335 IonicContact NH2-OE2 2.75Å; R311-E335 PolarHBondContact NH2-OE2 2.83Å; M333-E335 PolarHBondContact O-N 3.25Å
336	H	97.3	Very high	95.9	Very high	25 Å²	25	85.9 Å²	85.9	12%	0.116	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.8	-179.2	-72.5	-86.5	0	0	0	109.8	I300 G309 C310 R334 E340 V343	I300-H336 HydrophobicContact CD1-CB 4.25Å; G309-H336 CarbonylContact C-O 3.46Å; G309-H336 VanDerWaalsContact CA-O 3.22Å; G309-H336 WeakPolarHBondContact CA-O 3.17Å; C310-H336 PolarHBondContact N-O 3.42Å; C310-H336 PolarHBondContact O-N 3.3Å; R334-H336 VanDerWaalsContact CD-CE1 3.48Å; R334-H336 WeakPolarHBondContact CD-CE1 3.48Å; R334-H336 WeakPolarHBondContact CD-NE2 3.32Å; R334-H336 PolarHBondContact NE-CE1 2.93Å; H336-E340 VanDerWaalsContact CA-OE1 3.29Å; H336-E340 WeakPolarHBondContact CA-OE1 3.36Å; H336-E340 IonicContact CE1-OE2 3.54Å; H336-E340 IonicContact CG-OE2 2.79Å; H336-E340 IonicContact ND1-OE2 2.91Å; H336-E340 PolarHBondContact ND1-OE2 3.03Å; H336-V343 HydrophobicContact CB-CG2 3.86Å
337	R	96.4	Very high	95.9	Very high	149 Å²	149	85 Å²	85	56%	0.562	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	154.3	179.3	-64	-179.2	176.6	-174	-0.6	111.1	I300 S308 Q339 E340	I300-R337 WeakPolarHBondContact CD1-O 3.44Å; S308-R337 WeakPolarHBondContact O-CA 3.39Å; R337-Q339 PolarHBondContact O-N 2.93Å; R337-E340 PolarHBondContact N-OE1 3.12Å; R337-E340 WeakPolarHBondContact O-CB 3.39Å; R337-E340 PolarHBondContact O-N 2.85Å
338	I	94.7	Very high	95.8	Very high	88 Å²	88	86 Å²	86	45%	0.451	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-48	-36.2	178.1	-61.8	156	0	0	0	112.6	S308 E340 G341	S308-I338 WeakPolarHBondContact O-CG1 3.34Å; S308-I338 PolarHBondContact O-N 3.43Å; S308-I338 VanDerWaalsContact O-N 3.12Å; I338-E340 PolarHBondContact O-N 2.51Å; I338-E340 VanDerWaalsContact O-N 3.17Å; I338-G341 PolarHBondContact O-N 2.86Å
339	Q	95.1	Very high	95.9	Very high	178 Å²	178	82.5 Å²	82.5	83%	0.832	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-58.8	-22.2	178.6	-67.5	171.3	-18	0	0	114.8	R337 G341	R337-Q339 PolarHBondContact O-N 2.93Å; Q339-G341 VanDerWaalsContact C-N 3.26Å; Q339-G341 PolarHBondContact O-N 3.41Å
340	E	95.1	Very high	96	Very high	71 Å²	71	77.9 Å²	77.9	33%	0.332	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-80.1	-7.6	177.4	-66.5	165.3	-114.8	0	0	112.9	I300 R334 H336 R337 I338 K342	I300-E340 HydrophobicContact CD1-CB 3.64Å; R334-E340 IonicContact CZ-OE2 3.88Å; R334-E340 IonicContact NE-OE2 3.15Å; R334-E340 IonicContact NH2-OE2 3.09Å; R334-E340 PolarHBondContact NH2-OE2 2.8Å; H336-E340 VanDerWaalsContact CA-OE1 3.29Å; H336-E340 WeakPolarHBondContact CA-OE1 3.36Å; H336-E340 IonicContact CE1-OE2 3.54Å; H336-E340 IonicContact CG-OE2 2.79Å; H336-E340 IonicContact ND1-OE2 2.91Å; H336-E340 PolarHBondContact ND1-OE2 3.03Å; R337-E340 PolarHBondContact N-OE1 3.12Å; R337-E340 WeakPolarHBondContact O-CB 3.39Å; R337-E340 PolarHBondContact O-N 2.85Å; I338-E340 PolarHBondContact O-N 2.51Å; I338-E340 VanDerWaalsContact O-N 3.17Å; E340-K342 PolarHBondContact O-N 2.83Å
341	G	95.6	Very high	96.1	Very high	34 Å²	34	75.2 Å²	75.2	35%	0.351	38%	0.377	S	S	.	.			trans	74.2	-54.5	177	0	0	0	0	0	114.5	P299 I300 I338 Q339	P299-G341 CarbonylContact C-O 3.52Å; P299-G341 WeakPolarHBondContact CA-O 3.45Å; I300-G341 PolarHBondContact N-O 2.8Å; I338-G341 PolarHBondContact O-N 2.86Å; Q339-G341 VanDerWaalsContact C-N 3.26Å; Q339-G341 PolarHBondContact O-N 3.41Å
342	K	97.2	Very high	96.2	Very high	118 Å²	118	69.5 Å²	69.5	51%	0.513	35%	0.35	S	S	.	.			trans	-141.3	157.6	-174.5	65.4	-178	-179.2	179.3	0	113	T296 M297 E340 V344	T296-K342 HydrophobicContact CG2-CB 4.28Å; T296-K342 HydrophobicContact CG2-CD 4.08Å; M297-K342 WeakPolarHBondContact O-CA 3.43Å; M297-K342 WeakPolarHBondContact O-CB 3.46Å; E340-K342 PolarHBondContact O-N 2.83Å; K342-V344 HydrophobicContact CD-CG2 4.36Å; K342-V344 HydrophobicContact CG-CG2 4.49Å
343	V	97.9	Very high	96.2	Very high	2 Å²	2	62 Å²	62	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.4	165.8	-169.6	0	0	0	0	109.1	T296 M297 I300 P312 H336 F345	T296-V343 CarbonylContact C-O 3.56Å; T296-V343 VanDerWaalsContact CA-O 3.29Å; T296-V343 WeakPolarHBondContact CA-O 3.28Å; M297-V343 HydrophobicContact CE-CB 3.89Å; M297-V343 HydrophobicContact CE-CG1 4.36Å; M297-V343 HydrophobicContact CE-CG2 4.07Å; M297-V343 HydrophobicContact CG-CB 4.23Å; M297-V343 HydrophobicContact CG-CG2 4.33Å; M297-V343 PolarHBondContact N-O 2.84Å; M297-V343 PolarHBondContact O-N 2.87Å; M297-V343 VanDerWaalsContact O-N 3.07Å; M297-V343 HydrophobicContact SD-CG2 4.47Å; I300-V343 HydrophobicContact CD1-CG2 4.32Å; I300-V343 HydrophobicContact CG1-CG2 3.92Å; P312-V343 HydrophobicContact CG-CG1 4.12Å; P312-V343 HydrophobicContact CG-CG2 4.26Å; H336-V343 HydrophobicContact CB-CG2 3.86Å; V343-F345 HydrophobicContact CB-CE2 4.41Å; V343-F345 HydrophobicContact CG1-CE1 4.25Å; V343-F345 HydrophobicContact CG1-CE2 3.9Å; V343-F345 HydrophobicContact CG1-CZ 3.76Å
344	V	98.1	Very high	96.2	Very high	70 Å²	70	62.5 Å²	62.5	42%	0.424	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.4	175.4	-173.5	0	0	0	0	109.3	A294 L295 T296 K342	A294-V344 HydrophobicContact CB-CG1 4.33Å; L295-V344 CarbonylContact O-C 3.49Å; L295-V344 WeakPolarHBondContact O-CA 3.44Å; T296-V344 HydrophobicContact CG2-CG2 4.15Å; K342-V344 HydrophobicContact CD-CG2 4.36Å; K342-V344 HydrophobicContact CG-CG2 4.49Å
345	F	98.1	Very high	96.4	Very high	15 Å²	15	55 Å²	55	7%	0.066	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	114.3	171.9	-51.3	-93.2	0	0	0	108.4	A294 L295 M297 P312 C314 T326 V343 L347	A294-F345 CarbonylContact C-O 3.51Å; A294-F345 WeakPolarHBondContact CA-O 3.4Å; A294-F345 WeakPolarHBondContact CB-O 3.19Å; L295-F345 HydrophobicContact CB-CD2 4.17Å; L295-F345 HydrophobicContact CD2-CD2 3.54Å; L295-F345 HydrophobicContact CD2-CE2 3.7Å; L295-F345 HydrophobicContact CG-CD2 4.41Å; L295-F345 PolarHBondContact N-O 3.08Å; L295-F345 PolarHBondContact O-N 2.87Å; M297-F345 HydrophobicContact CE-CE2 3.52Å; M297-F345 HydrophobicContact CE-CZ 3.68Å; P312-F345 HydrophobicContact CB-CZ 3.98Å; P312-F345 HydrophobicContact CG-CE1 4.39Å; P312-F345 HydrophobicContact CG-CZ 3.88Å; C314-F345 HydrophobicContact CB-CD1 4.05Å; C314-F345 HydrophobicContact CB-CD2 4.35Å; C314-F345 HydrophobicContact CB-CE1 4.34Å; C314-F345 HydrophobicContact CB-CG 4.06Å; T326-F345 HydrophobicContact CG2-CB 4.4Å; T326-F345 HydrophobicContact CG2-CD1 4.18Å; V343-F345 HydrophobicContact CB-CE2 4.41Å; V343-F345 HydrophobicContact CG1-CE1 4.25Å; V343-F345 HydrophobicContact CG1-CE2 3.9Å; V343-F345 HydrophobicContact CG1-CZ 3.76Å; F345-L347 HydrophobicContact CB-CD2 3.92Å; F345-L347 HydrophobicContact CB-CG 4.39Å
346	P	97.4	Very high	96.5	Very high	108 Å²	108	51.9 Å²	51.9	70%	0.701	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	129.4	162.2	29.5	-31.5	0	0	0	108.4
347	L	97.1	Very high	96.6	Very high	13 Å²	13	50.7 Å²	50.7	7%	0.068	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-56.3	-176	-58.8	178.7	0	0	0	110.9	I292 K293 L295 C314 V316 F324 T326 F345 V349	I292-L347 HydrophobicContact CG2-CD1 3.8Å; K293-L347 PolarHBondContact O-N 3.35Å; L295-L347 HydrophobicContact CB-CD1 3.96Å; C314-L347 HydrophobicContact CB-CD2 4.38Å; V316-L347 HydrophobicContact CG2-CD1 4.27Å; F324-L347 HydrophobicContact CD1-CD2 4.14Å; F324-L347 HydrophobicContact CE1-CB 4.48Å; F324-L347 HydrophobicContact CE1-CD2 3.64Å; T326-L347 HydrophobicContact CG2-CD2 3.81Å; F345-L347 HydrophobicContact CB-CD2 3.92Å; F345-L347 HydrophobicContact CB-CG 4.39Å; L347-V349 HydrophobicContact CB-CG2 4.28Å; L347-V349 PolarHBondContact O-N 3.28Å
348	G	96.5	Very high	96.6	Very high	59 Å²	59	43.6 Å²	43.6	61%	0.608	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	64.7	31	177.4	0	0	0	0	0	114.9	I292 K293	I292-G348 WeakPolarHBondContact O-CA 3.21Å; I292-G348 PolarHBondContact O-N 3.15Å; K293-G348 PolarHBondContact O-N 2.54Å; K293-G348 VanDerWaalsContact O-N 3.11Å
349	V	97	Very high	96.8	Very high	18 Å²	18	39.4 Å²	39.4	11%	0.109	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	127.2	-172.2	-65.3	0	0	0	0	112.7	V291 I292 V316 F324 L347 V351	V291-V349 CarbonylContact C-O 3.44Å; V291-V349 WeakPolarHBondContact CA-O 3.34Å; I292-V349 HydrophobicContact CB-CG2 4.01Å; I292-V349 HydrophobicContact CD1-CG2 4.48Å; I292-V349 PolarHBondContact N-O 2.96Å; I292-V349 PolarHBondContact O-N 3.3Å; V316-V349 HydrophobicContact CG1-CG2 4.34Å; V316-V349 HydrophobicContact CG2-CG2 4.36Å; F324-V349 HydrophobicContact CB-CG1 3.85Å; F324-V349 HydrophobicContact CD1-CG1 4.13Å; F324-V349 HydrophobicContact CD2-CG1 3.72Å; F324-V349 HydrophobicContact CE2-CG1 4.28Å; F324-V349 HydrophobicContact CG-CG1 3.64Å; L347-V349 HydrophobicContact CB-CG2 4.28Å; L347-V349 PolarHBondContact O-N 3.28Å; V349-V351 HydrophobicContact CG2-CG1 4.24Å
350	S	96.4	Very high	97	Very high	47 Å²	47	32.8 Å²	32.8	33%	0.329	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.7	169.6	176.2	0	0	0	0	109.9	E425 K429	S350-E425 WeakPolarHBondContact CB-OE1 3.31Å; S350-E425 PolarHBondContact OG-OE1 3.18Å; S350-K429 PolarHBondContact OG-NZ 2.92Å
351	V	96	Very high	97.1	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	158.4	-176.2	-60.4	0	0	0	0	111.9	P289 L290 I292 V316 I318 I323 V349 V355 T386	P289-V351 CarbonylContact C-O 3.53Å; P289-V351 WeakPolarHBondContact CA-O 3.43Å; L290-V351 HydrophobicContact CB-CG2 4.23Å; L290-V351 PolarHBondContact N-O 2.83Å; L290-V351 VanDerWaalsContact O-CG2 3.27Å; L290-V351 WeakPolarHBondContact O-CG2 3.28Å; L290-V351 PolarHBondContact O-N 3.48Å; I292-V351 HydrophobicContact CD1-CG2 3.98Å; I292-V351 HydrophobicContact CG1-CG2 4.08Å; V316-V351 HydrophobicContact CG1-CG1 4.24Å; I318-V351 HydrophobicContact CD1-CB 4.12Å; I318-V351 HydrophobicContact CD1-CG1 4.23Å; I318-V351 HydrophobicContact CG1-CB 4.39Å; I318-V351 HydrophobicContact CG1-CG1 4.4Å; I323-V351 HydrophobicContact CD1-CG1 3.45Å; I323-V351 VanDerWaalsContact CD1-CG1 3.45Å; V349-V351 HydrophobicContact CG2-CG1 4.24Å; V351-V355 HydrophobicContact CB-CG2 3.86Å; V351-V355 HydrophobicContact CG2-CG1 4.24Å; V351-V355 HydrophobicContact CG2-CG2 3.62Å; V351-T386 HydrophobicContact CG2-CG2 4.08Å
352	Q	94.3	Very high	97.1	Very high	55 Å²	55	28.9 Å²	28.9	26%	0.257	17%	0.174	S	C	.	.			trans	-151.6	144	-179.4	-173.4	-176.5	-11	0	0	110	S287 K429	S287-Q352 PolarHBondContact O-NE2 3.26Å; S287-Q352 VanDerWaalsContact O-NE2 3.12Å; Q352-K429 VanDerWaalsContact OE1-CB 3.29Å
353	G	94.3	Very high	96.9	Very high	16 Å²	16	28 Å²	28	17%	0.165	17%	0.167	C	C	.	.	S	Bend	trans	83.8	-142.5	178.7	0	0	0	0	0	112.8	V355 H385 T386	G353-V355 PolarHBondContact O-N 3.36Å; G353-H385 VanDerWaalsContact C-CD2 3.48Å; G353-H385 CarbonylContact O-C 3.58Å; G353-H385 VanDerWaalsContact O-CA 3.32Å; G353-H385 WeakPolarHBondContact O-CA 3.26Å; G353-T386 PolarHBondContact N-OG1 3.32Å; G353-T386 PolarHBondContact O-N 3.34Å
354	D	96.3	Very high	96.5	Very high	20 Å²	20	29.4 Å²	29.4	11%	0.107	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	111.3	179.6	-53.2	-79.3	0	0	0	111.1	S196 L197 Y270 I318 G319 H385	S196-D354 WeakPolarHBondContact CA-OD1 3.45Å; S196-D354 WeakPolarHBondContact CB-OD2 3.33Å; L197-D354 WeakPolarHBondContact CB-OD1 3.23Å; L197-D354 PolarHBondContact N-OD1 3.08Å; Y270-D354 VanDerWaalsContact CE1-OD1 3.26Å; Y270-D354 WeakPolarHBondContact CE1-OD1 3.27Å; Y270-D354 WeakPolarHBondContact OH-CB 3.41Å; Y270-D354 PolarHBondContact OH-OD1 2.91Å; I318-D354 CarbonylContact C-O 3.55Å; I318-D354 WeakPolarHBondContact CA-O 3.26Å; G319-D354 PolarHBondContact N-O 3.17Å; D354-H385 IonicContact OD1-CD2 3.2Å; D354-H385 PolarHBondContact OD1-CD2 3.21Å
355	V	97.9	Very high	95.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.7	-175.9	179.6	0	0	0	0	110.4	I292 V316 V351 G353 V357 Q383 F384 T386	I292-V355 HydrophobicContact CD1-CG1 4.22Å; V316-V355 HydrophobicContact CG1-CG1 4.3Å; V351-V355 HydrophobicContact CB-CG2 3.86Å; V351-V355 HydrophobicContact CG2-CG1 4.24Å; V351-V355 HydrophobicContact CG2-CG2 3.62Å; G353-V355 PolarHBondContact O-N 3.36Å; V355-V357 HydrophobicContact CG1-CG2 4.11Å; V355-Q383 VanDerWaalsContact O-CA 3.26Å; V355-Q383 WeakPolarHBondContact O-CA 3.22Å; V355-Q383 WeakPolarHBondContact O-CG 3.48Å; V355-F384 HydrophobicContact CB-CD2 4.35Å; V355-F384 HydrophobicContact CB-CE1 4.34Å; V355-F384 HydrophobicContact CB-CE2 3.92Å; V355-F384 HydrophobicContact CB-CZ 3.92Å; V355-F384 HydrophobicContact CG1-CE1 4.09Å; V355-F384 HydrophobicContact CG1-CE2 4.21Å; V355-F384 HydrophobicContact CG1-CZ 3.72Å; V355-F384 HydrophobicContact CG2-CE2 4.26Å; V355-F384 PolarHBondContact N-O 3.48Å; V355-F384 PolarHBondContact O-N 2.97Å; V355-T386 HydrophobicContact CG2-CG2 3.63Å
356	V	98.1	Very high	95	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	132.3	170.4	-172.3	0	0	0	0	109.2	L317 Q381 I382 Q383	L317-V356 HydrophobicContact CB-CB 4.24Å; L317-V356 HydrophobicContact CD1-CB 4.1Å; L317-V356 HydrophobicContact CD1-CG1 4.19Å; L317-V356 PolarHBondContact N-O 2.68Å; L317-V356 PolarHBondContact O-N 3.28Å; V356-Q381 HydrophobicContact CG1-CG 3.68Å; V356-I382 CarbonylContact C-O 3.17Å; V356-I382 WeakPolarHBondContact CA-O 3.4Å; V356-Q383 HydrophobicContact CG2-CB 4.18Å; V356-Q383 HydrophobicContact CG2-CG 3.87Å
357	V	98.3	Very high	93.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.9	172.9	-173.1	0	0	0	0	108.4	I292 L295 V316 V355 Q381 I382 F384	I292-V357 HydrophobicContact CD1-CG2 4.17Å; L295-V357 HydrophobicContact CD1-CG1 3.63Å; V316-V357 HydrophobicContact CG1-CG2 4.43Å; V316-V357 HydrophobicContact CG2-CG1 4.46Å; V355-V357 HydrophobicContact CG1-CG2 4.11Å; V357-Q381 CarbonylContact O-C 3.43Å; V357-Q381 WeakPolarHBondContact O-CA 3.38Å; V357-I382 PolarHBondContact N-O 2.86Å; V357-I382 PolarHBondContact O-N 2.98Å; V357-F384 HydrophobicContact CG2-CE1 4.21Å
358	S	97.9	Very high	92.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.9	-176.3	-73.9	0	0	0	0	111.3	C314 D315 Y360 Q378 Q381	C314-S358 CarbonylContact C-O 3.59Å; C314-S358 WeakPolarHBondContact CA-O 3.42Å; D315-S358 PolarHBondContact N-O 2.79Å; D315-S358 PolarHBondContact O-N 3.38Å; S358-Y360 VanDerWaalsContact CB-CE2 3.47Å; S358-Y360 WeakPolarHBondContact CB-OH 3.16Å; S358-Q378 PolarHBondContact OG-NE2 3.43Å; S358-Q381 WeakPolarHBondContact OG-CG 3.46Å; S358-Q381 PolarHBondContact OG-OE1 3.22Å
359	V	98.5	Very high	91.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.4	178.4	172.3	0	0	0	0	110	L295 M297 P312 F313 C314 I379 F380	L295-V359 HydrophobicContact CD1-CG2 4.06Å; L295-V359 HydrophobicContact CD2-CG2 4.36Å; M297-V359 HydrophobicContact CE-CG1 3.87Å; P312-V359 HydrophobicContact CB-CG1 4.19Å; F313-V359 VanDerWaalsContact O-CA 3.3Å; F313-V359 WeakPolarHBondContact O-CA 3.38Å; C314-V359 HydrophobicContact CB-CG2 4.14Å; V359-I379 HydrophobicContact CG1-CB 4.19Å; V359-I379 HydrophobicContact CG1-CD1 4.07Å; V359-I379 HydrophobicContact CG1-CG1 4.39Å; V359-I379 PolarHBondContact O-N 2.82Å; V359-F380 HydrophobicContact CB-CD1 4.22Å; V359-F380 HydrophobicContact CB-CD2 4.45Å; V359-F380 HydrophobicContact CB-CE1 3.76Å; V359-F380 HydrophobicContact CB-CE2 4.02Å; V359-F380 HydrophobicContact CB-CZ 3.66Å; V359-F380 HydrophobicContact CG1-CE1 4.11Å; V359-F380 HydrophobicContact CG1-CZ 4.35Å; V359-F380 HydrophobicContact CG2-CE1 3.92Å; V359-F380 HydrophobicContact CG2-CE2 3.68Å; V359-F380 HydrophobicContact CG2-CZ 3.31Å; V359-F380 PolarHBondContact N-O 3.13Å; V359-F380 PolarHBondContact O-N 2.83Å
360	Y	98.4	Very high	90.3	Very high	39 Å²	39	45.6 Å²	45.6	15%	0.153	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.9	-173.8	-54.7	-94.2	0	0	0	112	P312 F313 D315 S358 T377 Q378	P312-Y360 CarbonylContact C-O 3.5Å; P312-Y360 VanDerWaalsContact CA-O 3.23Å; P312-Y360 WeakPolarHBondContact CA-O 3.38Å; F313-Y360 WeakPolarHBondContact CD1-O 3.27Å; F313-Y360 HydrophobicContact CD2-CD2 4.16Å; F313-Y360 HydrophobicContact CE1-CG 4.47Å; F313-Y360 AromaticContact CE2-CD2 3.53Å; F313-Y360 HydrophobicContact CE2-CD2 3.53Å; F313-Y360 HydrophobicContact CE2-CE2 4.34Å; F313-Y360 HydrophobicContact CE2-CG 4.06Å; F313-Y360 AromaticContact CZ-CD2 3.84Å; F313-Y360 HydrophobicContact CZ-CD2 3.84Å; F313-Y360 AromaticContact CZ-CG 3.89Å; F313-Y360 HydrophobicContact CZ-CG 3.89Å; F313-Y360 PolarHBondContact N-O 2.86Å; F313-Y360 PolarHBondContact O-N 2.82Å; D315-Y360 HydrophobicContact CB-CE2 4.24Å; D315-Y360 VanDerWaalsContact OD2-CE2 3.3Å; D315-Y360 WeakPolarHBondContact OD2-CE2 3.41Å; S358-Y360 VanDerWaalsContact CB-CE2 3.47Å; S358-Y360 WeakPolarHBondContact CB-OH 3.16Å; Y360-T377 CarbonylContact C-O 3.52Å; Y360-T377 WeakPolarHBondContact CA-O 3.5Å; Y360-Q378 HydrophobicContact CD1-CB 3.74Å; Y360-Q378 HydrophobicContact CD1-CG 3.85Å; Y360-Q378 HydrophobicContact CE1-CB 3.77Å; Y360-Q378 HydrophobicContact CE1-CG 3.56Å; Y360-Q378 PolarHBondContact OH-NE2 2.93Å
361	H	97.6	Very high	89.2	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.032	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	124.8	164.9	173.4	34.9	0	0	0	109.8	F303 R311 N376 T377 I379	F303-H361 HydrophobicContact CB-CB 3.73Å; F303-H361 HydrophobicContact CD1-CB 4.15Å; F303-H361 HydrophobicContact CG-CB 4.19Å; F303-H361 PolarHBondContact O-CD2 3.47Å; R311-H361 PolarHBondContact N-ND1 2.92Å; R311-H361 VanDerWaalsContact N-ND1 3.13Å; R311-H361 CarbonylContact O-C 3.6Å; R311-H361 WeakPolarHBondContact O-CA 3.09Å; R311-H361 PolarHBondContact O-ND1 2.8Å; H361-N376 CarbonylContact O-C 3.57Å; H361-N376 WeakPolarHBondContact O-CA 3.36Å; H361-T377 PolarHBondContact N-O 2.9Å; H361-T377 PolarHBondContact O-N 3.11Å; H361-I379 HydrophobicContact CB-CD1 4.05Å; H361-I379 HydrophobicContact CB-CG1 4.17Å
362	M	96.3	Very high	88.3	Confident	16 Å²	16	53.6 Å²	53.6	8%	0.079	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.4	170	-162.1	-176.5	-69	0	0	111.5	R311 F313 Q328 Y330 M333 V374	R311-M362 PolarHBondContact O-N 3Å; F313-M362 HydrophobicContact CD1-CB 4.19Å; F313-M362 HydrophobicContact CD1-CE 3.8Å; F313-M362 HydrophobicContact CE1-CB 4.18Å; F313-M362 HydrophobicContact CE1-CE 3.78Å; Q328-M362 WeakPolarHBondContact O-CE 3.22Å; Y330-M362 HydrophobicContact CD2-CB 4.49Å; Y330-M362 HydrophobicContact CD2-CG 3.93Å; Y330-M362 HydrophobicContact CD2-SD 4Å; M333-M362 HydrophobicContact CG-CE 3.95Å; M333-M362 HydrophobicContact CG-SD 3.95Å; M362-V374 HydrophobicContact CG-CG1 3.61Å; M362-V374 HydrophobicContact SD-CG1 3.73Å
363	R	91.7	Very high	88	Confident	98 Å²	98	57.8 Å²	57.8	37%	0.37	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	119.5	-171.9	-175.9	-169.2	-166.7	-140.4	8.8	110.5	T365 S375	R363-T365 HydrophobicContact CG-CG2 4.34Å; R363-S375 PolarHBondContact N-O 3.42Å; R363-S375 PolarHBondContact O-N 2.96Å; R363-S375 PolarHBondContact O-OG 3.22Å
364	S	90.2	Very high	87.8	Confident	32 Å²	32	60.6 Å²	60.6	22%	0.224	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	137.4	167.7	-176.8	0	0	0	0	110.8	Y330	Y330-S364 VanDerWaalsContact CE2-N 3.27Å
365	T	84.6	Confident	87.7	Confident	37 Å²	37	61.4 Å²	61.4	23%	0.227	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	138.3	170.7	56	0	0	0	0	109.5	R363 G367 K373	R363-T365 HydrophobicContact CG-CG2 4.34Å; T365-G367 PolarHBondContact O-N 2.79Å; T365-K373 PolarHBondContact N-O 3.34Å; T365-K373 PolarHBondContact O-N 3.14Å; T365-K373 PolarHBondContact OG1-O 3.12Å
366	I	80	Confident	87.6	Confident	126 Å²	126	65.7 Å²	65.7	65%	0.646	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.3	174.2	-162.1	165.4	0	0	0	108.6	L370	I366-L370 HydrophobicContact CD1-CD2 3.77Å; I366-L370 HydrophobicContact CG1-CD2 4.37Å
367	G	74.2	Confident	87.5	Confident	26 Å²	26	68 Å²	68	27%	0.268	38%	0.376	S	S	.	.			trans	-82.8	167.3	179.4	0	0	0	0	0	112.3	T365 R369 L370 Q371	T365-G367 PolarHBondContact O-N 2.79Å; G367-R369 PolarHBondContact O-N 3.09Å; G367-L370 WeakPolarHBondContact O-CA 3.34Å; G367-L370 PolarHBondContact O-N 3.31Å; G367-Q371 PolarHBondContact N-O 3.26Å
368	G	69.1	Low	87.4	Confident	96 Å²	96	70.2 Å²	70.2	99%	0.99	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-1	-178.3	0	0	0	0	0	116.7
369	R	74.3	Confident	87.4	Confident	192 Å²	192	70.2 Å²	70.2	73%	0.725	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	22.4	169.7	-68.2	-173.5	173	-171.9	-4.3	112.4	G367 Q371 S966	G367-R369 PolarHBondContact O-N 3.09Å; R369-Q371 PolarHBondContact O-N 2.7Å; R369-S966 PolarHBondContact NH2-O 3.44Å; R369-S966 VanDerWaalsContact NH2-O 3.12Å
370	L	73	Confident	87.4	Confident	146 Å²	146	70.2 Å²	70.2	76%	0.764	39%	0.386	S	S	*	.	S	Bend	trans	58.2	1.1	-172.3	-64.1	172.1	0	0	0	116.2	I366 G367	I366-L370 HydrophobicContact CD1-CD2 3.77Å; I366-L370 HydrophobicContact CG1-CD2 4.37Å; G367-L370 WeakPolarHBondContact O-CA 3.34Å; G367-L370 PolarHBondContact O-N 3.31Å
371	Q	72.4	Confident	87.4	Confident	143 Å²	143	68.9 Å²	68.9	67%	0.668	38%	0.381	S	S	*	.			trans	-74.6	139.7	175.3	-68.5	174.5	-21.5	0	0	111.4	G367 R369 K373	G367-Q371 PolarHBondContact N-O 3.26Å; R369-Q371 PolarHBondContact O-N 2.7Å; Q371-K373 PolarHBondContact O-N 2.92Å
372	A	77.6	Confident	87.4	Confident	75 Å²	75	68.5 Å²	68.5	62%	0.62	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	104.8	175.2	0	0	0	0	0	110.9	V374	A372-V374 PolarHBondContact O-N 3.27Å
373	K	88	Confident	87.4	Confident	143 Å²	143	67.8 Å²	67.8	62%	0.622	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.1	103.2	170.6	-173.7	178.8	-179.4	-177.5	0	108.6	T365 Q371	T365-K373 PolarHBondContact N-O 3.34Å; T365-K373 PolarHBondContact O-N 3.14Å; T365-K373 PolarHBondContact OG1-O 3.12Å; Q371-K373 PolarHBondContact O-N 2.92Å
374	V	90.3	Very high	87.7	Confident	75 Å²	75	63.1 Å²	63.1	46%	0.455	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	135.6	168.1	-176.6	0	0	0	0	108.9	Y330 M362 A372	Y330-V374 HydrophobicContact CD2-CG1 4.5Å; Y330-V374 HydrophobicContact CG-CG2 4.33Å; M362-V374 HydrophobicContact CG-CG1 3.61Å; M362-V374 HydrophobicContact SD-CG1 3.73Å; A372-V374 PolarHBondContact O-N 3.27Å
375	S	93.6	Very high	88.1	Confident	37 Å²	37	62.3 Å²	62.3	26%	0.259	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	165.7	177.3	59.5	0	0	0	0	109.3	R363	R363-S375 PolarHBondContact N-O 3.42Å; R363-S375 PolarHBondContact O-N 2.96Å; R363-S375 PolarHBondContact O-OG 3.22Å
376	N	95.1	Very high	88.6	Confident	90 Å²	90	60.6 Å²	60.6	48%	0.481	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	163.3	169.7	69.4	59.2	0	0	0	111.3	F313 H361	F313-N376 HydrophobicContact CE1-CB 4.02Å; F313-N376 HydrophobicContact CZ-CB 4.19Å; H361-N376 CarbonylContact O-C 3.57Å; H361-N376 WeakPolarHBondContact O-CA 3.36Å
377	T	95.6	Very high	89.3	Confident	50 Å²	50	54.8 Å²	54.8	31%	0.307	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	127.9	177.7	-53.3	0	0	0	0	107.7	F303 Y360 H361	F303-T377 HydrophobicContact CD1-CG2 4.28Å; F303-T377 HydrophobicContact CE1-CG2 4.2Å; Y360-T377 CarbonylContact C-O 3.52Å; Y360-T377 WeakPolarHBondContact CA-O 3.5Å; H361-T377 PolarHBondContact N-O 2.9Å; H361-T377 PolarHBondContact O-N 3.11Å
378	Q	96.8	Very high	90.4	Very high	46 Å²	46	54.6 Å²	54.6	22%	0.215	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	133.1	-176.2	-159.5	160.3	14.9	0	0	110.4	F303 S358 Y360 A405	F303-Q378 WeakPolarHBondContact CE1-O 3.43Å; S358-Q378 PolarHBondContact OG-NE2 3.43Å; Y360-Q378 HydrophobicContact CD1-CB 3.74Å; Y360-Q378 HydrophobicContact CD1-CG 3.85Å; Y360-Q378 HydrophobicContact CE1-CB 3.77Å; Y360-Q378 HydrophobicContact CE1-CG 3.56Å; Y360-Q378 PolarHBondContact OH-NE2 2.93Å; Q378-A405 HydrophobicContact CG-CB 4.14Å
379	I	98.1	Very high	91.7	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-41.9	176.1	-54.3	-173.1	0	0	0	109.4	P301 F303 C310 P312 V359 H361 Y412	P301-I379 HydrophobicContact CB-CG2 4.36Å; P301-I379 HydrophobicContact CG-CD1 4.42Å; P301-I379 HydrophobicContact CG-CG2 3.76Å; F303-I379 HydrophobicContact CD1-CG1 4.13Å; F303-I379 HydrophobicContact CD2-CD1 4.38Å; F303-I379 HydrophobicContact CD2-CG1 4.18Å; F303-I379 HydrophobicContact CD2-CG2 4.24Å; F303-I379 HydrophobicContact CE1-CG1 4.15Å; F303-I379 HydrophobicContact CE2-CB 4.28Å; F303-I379 HydrophobicContact CE2-CG1 4.21Å; F303-I379 HydrophobicContact CE2-CG2 3.74Å; F303-I379 HydrophobicContact CG-CD1 4.42Å; F303-I379 HydrophobicContact CG-CG1 4.15Å; F303-I379 HydrophobicContact CZ-CB 4.19Å; F303-I379 HydrophobicContact CZ-CG1 4.19Å; F303-I379 HydrophobicContact CZ-CG2 4.07Å; C310-I379 HydrophobicContact CB-CD1 4.28Å; P312-I379 HydrophobicContact CB-CD1 3.99Å; V359-I379 HydrophobicContact CG1-CB 4.19Å; V359-I379 HydrophobicContact CG1-CD1 4.07Å; V359-I379 HydrophobicContact CG1-CG1 4.39Å; V359-I379 PolarHBondContact O-N 2.82Å; H361-I379 HydrophobicContact CB-CD1 4.05Å; H361-I379 HydrophobicContact CB-CG1 4.17Å; I379-Y412 HydrophobicContact CG2-CE1 4.28Å; I379-Y412 WeakPolarHBondContact O-CE1 3.37Å; I379-Y412 PolarHBondContact O-OH 3.16Å
380	F	98.2	Very high	92.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	171.8	169.6	60.2	-98.2	0	0	0	110.7	L295 M297 V359 I382 L403 D404 F416 V418	L295-F380 HydrophobicContact CD1-CE2 4.22Å; L295-F380 HydrophobicContact CD1-CZ 4.09Å; L295-F380 HydrophobicContact CD2-CZ 4.19Å; M297-F380 HydrophobicContact CB-CE1 4.36Å; M297-F380 HydrophobicContact SD-CE1 4.5Å; V359-F380 HydrophobicContact CB-CD1 4.22Å; V359-F380 HydrophobicContact CB-CD2 4.45Å; V359-F380 HydrophobicContact CB-CE1 3.76Å; V359-F380 HydrophobicContact CB-CE2 4.02Å; V359-F380 HydrophobicContact CB-CZ 3.66Å; V359-F380 HydrophobicContact CG1-CE1 4.11Å; V359-F380 HydrophobicContact CG1-CZ 4.35Å; V359-F380 HydrophobicContact CG2-CE1 3.92Å; V359-F380 HydrophobicContact CG2-CE2 3.68Å; V359-F380 HydrophobicContact CG2-CZ 3.31Å; V359-F380 PolarHBondContact N-O 3.13Å; V359-F380 PolarHBondContact O-N 2.83Å; F380-I382 HydrophobicContact CD2-CD1 4.13Å; F380-I382 HydrophobicContact CD2-CG1 3.99Å; F380-I382 HydrophobicContact CE2-CD1 3.87Å; F380-I382 HydrophobicContact CE2-CG1 4.2Å; F380-L403 HydrophobicContact CB-CB 4.13Å; F380-L403 HydrophobicContact CB-CD1 4.02Å; F380-L403 HydrophobicContact CD1-CD1 4.41Å; F380-L403 HydrophobicContact CD2-CD2 4.39Å; F380-L403 HydrophobicContact CG-CD1 4.18Å; F380-D404 WeakPolarHBondContact CA-O 3.23Å; F380-F416 HydrophobicContact CD1-CE1 4.1Å; F380-F416 HydrophobicContact CD1-CZ 4.04Å; F380-F416 HydrophobicContact CE1-CZ 4.1Å; F380-V418 HydrophobicContact CD1-CG2 3.99Å; F380-V418 HydrophobicContact CD2-CG2 4.27Å; F380-V418 HydrophobicContact CE1-CG2 3.5Å; F380-V418 HydrophobicContact CE2-CB 4.48Å; F380-V418 HydrophobicContact CE2-CG1 3.98Å; F380-V418 HydrophobicContact CE2-CG2 3.82Å; F380-V418 HydrophobicContact CG-CG2 4.36Å; F380-V418 HydrophobicContact CZ-CB 4.23Å; F380-V418 HydrophobicContact CZ-CG1 3.74Å; F380-V418 HydrophobicContact CZ-CG2 3.4Å
381	Q	97.9	Very high	93.5	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.051	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.6	165.4	174.4	173.1	-53.9	0	0	109.8	R192 V356 V357 S358 D404 A405	R192-Q381 PolarHBondContact O-NE2 2.79Å; V356-Q381 HydrophobicContact CG1-CG 3.68Å; V357-Q381 CarbonylContact O-C 3.43Å; V357-Q381 WeakPolarHBondContact O-CA 3.38Å; S358-Q381 WeakPolarHBondContact OG-CG 3.46Å; S358-Q381 PolarHBondContact OG-OE1 3.22Å; Q381-D404 HydrophobicContact CB-CB 4.03Å; Q381-D404 HydrophobicContact CG-CB 4.39Å; Q381-D404 PolarHBondContact N-O 2.79Å; Q381-D404 WeakPolarHBondContact O-CB 3.3Å; Q381-D404 PolarHBondContact O-N 3.15Å; Q381-A405 HydrophobicContact CB-CB 4Å
382	I	97.8	Very high	94.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.8	175.4	-56.5	169	0	0	0	106.8	V356 V357 F380 F384 F398 L403 V418	V356-I382 CarbonylContact C-O 3.17Å; V356-I382 WeakPolarHBondContact CA-O 3.4Å; V357-I382 PolarHBondContact N-O 2.86Å; V357-I382 PolarHBondContact O-N 2.98Å; F380-I382 HydrophobicContact CD2-CD1 4.13Å; F380-I382 HydrophobicContact CD2-CG1 3.99Å; F380-I382 HydrophobicContact CE2-CD1 3.87Å; F380-I382 HydrophobicContact CE2-CG1 4.2Å; I382-F384 HydrophobicContact CG2-CD1 4.21Å; I382-F398 HydrophobicContact CD1-CB 4.26Å; I382-F398 HydrophobicContact CD1-CD2 3.78Å; I382-F398 HydrophobicContact CD1-CE2 4.32Å; I382-F398 HydrophobicContact CD1-CG 4.05Å; I382-F398 HydrophobicContact CG2-CD1 3.96Å; I382-F398 HydrophobicContact CG2-CD2 4.11Å; I382-F398 HydrophobicContact CG2-CE1 3.68Å; I382-F398 HydrophobicContact CG2-CE2 3.84Å; I382-F398 HydrophobicContact CG2-CG 4.16Å; I382-F398 HydrophobicContact CG2-CZ 3.62Å; I382-L403 HydrophobicContact CD1-CD2 3.68Å; I382-L403 HydrophobicContact CG1-CD2 3.55Å; I382-V418 HydrophobicContact CD1-CB 4.01Å; I382-V418 HydrophobicContact CD1-CG1 3.76Å; I382-V418 HydrophobicContact CD1-CG2 4.45Å
383	Q	97.9	Very high	95.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	134.6	172.1	178.8	-174.1	0.8	0	0	111.8	A194 S266 R269 Y270 V355 V356	A194-Q383 PolarHBondContact O-NE2 2.84Å; S266-Q383 PolarHBondContact OG-N 2.97Å; S266-Q383 PolarHBondContact OG-O 2.78Å; R269-Q383 PolarHBondContact NH1-O 2.9Å; Y270-Q383 HydrophobicContact CE2-CG 3.69Å; Y270-Q383 VanDerWaalsContact CZ-NE2 3.3Å; Y270-Q383 WeakPolarHBondContact OH-CG 3.49Å; Y270-Q383 PolarHBondContact OH-NE2 3.48Å; Y270-Q383 VanDerWaalsContact OH-NE2 3.16Å; V355-Q383 VanDerWaalsContact O-CA 3.26Å; V355-Q383 WeakPolarHBondContact O-CA 3.22Å; V355-Q383 WeakPolarHBondContact O-CG 3.48Å; V356-Q383 HydrophobicContact CG2-CB 4.18Å; V356-Q383 HydrophobicContact CG2-CG 3.87Å
384	F	98	Very high	95.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	175.8	179.5	58.5	-88.9	0	0	0	110	Y270 L290 I292 V355 V357 I382 T386 I389 L396 F398 L420	Y270-F384 PolarHBondContact OH-O 2.88Å; L290-F384 HydrophobicContact CD2-CE2 3.63Å; L290-F384 HydrophobicContact CD2-CZ 4.11Å; I292-F384 HydrophobicContact CD1-CZ 4.2Å; V355-F384 HydrophobicContact CB-CD2 4.35Å; V355-F384 HydrophobicContact CB-CE1 4.34Å; V355-F384 HydrophobicContact CB-CE2 3.92Å; V355-F384 HydrophobicContact CB-CZ 3.92Å; V355-F384 HydrophobicContact CG1-CE1 4.09Å; V355-F384 HydrophobicContact CG1-CE2 4.21Å; V355-F384 HydrophobicContact CG1-CZ 3.72Å; V355-F384 HydrophobicContact CG2-CE2 4.26Å; V355-F384 PolarHBondContact N-O 3.48Å; V355-F384 PolarHBondContact O-N 2.97Å; V357-F384 HydrophobicContact CG2-CE1 4.21Å; I382-F384 HydrophobicContact CG2-CD1 4.21Å; F384-T386 HydrophobicContact CE2-CG2 4.45Å; F384-I389 HydrophobicContact CD2-CD1 4.19Å; F384-I389 HydrophobicContact CD2-CG1 4.22Å; F384-L396 HydrophobicContact CE2-CD1 4.38Å; F384-L396 HydrophobicContact CZ-CD1 4.38Å; F384-F398 HydrophobicContact CD1-CZ 4.46Å; F384-L420 HydrophobicContact CE1-CD1 3.64Å; F384-L420 HydrophobicContact CZ-CD1 4.04Å
385	H	97.3	Very high	96.1	Very high	14 Å²	14	33.9 Å²	33.9	7%	0.065	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125	174.1	-179.6	-80.3	0	0	0	109.6	Y273 G353 D354 G387 F388	Y273-H385 HydrophobicContact CD2-CB 4.11Å; Y273-H385 HydrophobicContact CE2-CB 3.64Å; Y273-H385 PolarHBondContact OH-N 2.98Å; G353-H385 VanDerWaalsContact C-CD2 3.48Å; G353-H385 CarbonylContact O-C 3.58Å; G353-H385 VanDerWaalsContact O-CA 3.32Å; G353-H385 WeakPolarHBondContact O-CA 3.26Å; D354-H385 IonicContact OD1-CD2 3.2Å; D354-H385 PolarHBondContact OD1-CD2 3.21Å; H385-G387 PolarHBondContact ND1-N 3.23Å; H385-G387 VanDerWaalsContact ND1-N 3.16Å; H385-G387 PolarHBondContact O-N 3.5Å; H385-G387 VanDerWaalsContact O-N 3.16Å; H385-F388 HydrophobicContact CB-CD2 4.18Å; H385-F388 AromaticContact ND1-CD2 3.73Å; H385-F388 PolarHBondContact O-N 2.95Å
386	T	96.3	Very high	96.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-58.7	-35.1	-170.6	65.7	0	0	0	0	113.2	H286 L290 V351 G353 V355 F384 F388 I389	H286-T386 PolarHBondContact CE1-O 3.42Å; H286-T386 PolarHBondContact NE2-O 2.83Å; L290-T386 HydrophobicContact CB-CG2 3.81Å; L290-T386 HydrophobicContact CD2-CG2 4.35Å; V351-T386 HydrophobicContact CG2-CG2 4.08Å; G353-T386 PolarHBondContact N-OG1 3.32Å; G353-T386 PolarHBondContact O-N 3.34Å; V355-T386 HydrophobicContact CG2-CG2 3.63Å; F384-T386 HydrophobicContact CE2-CG2 4.45Å; T386-F388 PolarHBondContact O-N 2.99Å; T386-F388 VanDerWaalsContact O-N 3.07Å; T386-I389 WeakPolarHBondContact O-CB 3.41Å; T386-I389 PolarHBondContact O-N 2.8Å
387	G	94.6	Very high	96.4	Very high	4 Å²	4	32.9 Å²	32.9	4%	0.041	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-64.8	-6.8	179.1	0	0	0	0	0	116.1	P285 H286 H385	P285-G387 VanDerWaalsContact CA-O 3.26Å; P285-G387 WeakPolarHBondContact CA-O 3.37Å; H286-G387 PolarHBondContact CD2-O 2.88Å; H286-G387 PolarHBondContact N-O 2.95Å; H286-G387 VanDerWaalsContact N-O 3.15Å; H286-G387 VanDerWaalsContact O-CA 3.3Å; H286-G387 WeakPolarHBondContact O-CA 3.39Å; H385-G387 PolarHBondContact ND1-N 3.23Å; H385-G387 VanDerWaalsContact ND1-N 3.16Å; H385-G387 PolarHBondContact O-N 3.5Å; H385-G387 VanDerWaalsContact O-N 3.16Å
388	F	95.8	Very high	96.6	Very high	23 Å²	23	30.8 Å²	30.8	10%	0.101	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-105.2	8.6	172.7	-74.8	-89.4	0	0	0	112.9	L197 Y273 M277 T283 P285 H385 T386	L197-F388 HydrophobicContact CD2-CD2 4.35Å; L197-F388 HydrophobicContact CD2-CE2 3.56Å; L197-F388 HydrophobicContact CD2-CZ 4.42Å; Y273-F388 HydrophobicContact CD1-CB 3.96Å; Y273-F388 AromaticContact CD1-CD1 3.65Å; Y273-F388 HydrophobicContact CD1-CD1 3.65Å; Y273-F388 AromaticContact CD1-CD2 3.71Å; Y273-F388 HydrophobicContact CD1-CD2 3.71Å; Y273-F388 HydrophobicContact CD1-CE1 4.06Å; Y273-F388 HydrophobicContact CD1-CE2 4.13Å; Y273-F388 AromaticContact CD1-CG 3.47Å; Y273-F388 HydrophobicContact CD1-CG 3.47Å; Y273-F388 VanDerWaalsContact CD1-CG 3.47Å; Y273-F388 HydrophobicContact CD1-CZ 4.29Å; Y273-F388 HydrophobicContact CD2-CD2 4.28Å; Y273-F388 HydrophobicContact CE1-CB 3.48Å; Y273-F388 VanDerWaalsContact CE1-CB 3.48Å; Y273-F388 HydrophobicContact CE1-CD1 4.06Å; Y273-F388 AromaticContact CE1-CD2 3.97Å; Y273-F388 HydrophobicContact CE1-CD2 3.97Å; Y273-F388 AromaticContact CE1-CG 3.56Å; Y273-F388 HydrophobicContact CE1-CG 3.56Å; Y273-F388 HydrophobicContact CG-CD1 4.43Å; Y273-F388 AromaticContact CG-CD2 3.88Å; Y273-F388 HydrophobicContact CG-CD2 3.88Å; Y273-F388 AromaticContact CG-CE2 3.99Å; Y273-F388 HydrophobicContact CG-CE2 3.99Å; Y273-F388 HydrophobicContact CG-CG 4.13Å; Y273-F388 HydrophobicContact CG-CZ 4.31Å; M277-F388 HydrophobicContact CG-CE1 4.47Å; M277-F388 HydrophobicContact CG-CZ 3.7Å; M277-F388 HydrophobicContact SD-CE2 4.22Å; M277-F388 HydrophobicContact SD-CZ 3.77Å; T283-F388 HydrophobicContact CG2-CD1 4.44Å; T283-F388 HydrophobicContact CG2-CE1 4.13Å; P285-F388 HydrophobicContact CB-CD2 4.03Å; P285-F388 HydrophobicContact CB-CE2 3.64Å; P285-F388 HydrophobicContact CB-CZ 4.27Å; P285-F388 HydrophobicContact CG-CE2 3.94Å; P285-F388 HydrophobicContact CG-CZ 4.37Å; H385-F388 HydrophobicContact CB-CD2 4.18Å; H385-F388 AromaticContact ND1-CD2 3.73Å; H385-F388 PolarHBondContact O-N 2.95Å; T386-F388 PolarHBondContact O-N 2.99Å; T386-F388 VanDerWaalsContact O-N 3.07Å
389	I	96.4	Very high	96.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-99.4	100.7	178.6	-51.8	-56	0	0	0	108.1	H286 L290 F384 T386 T393 L396 V424 L485	H286-I389 PolarHBondContact NE2-O 3.32Å; L290-I389 HydrophobicContact CD1-CB 4.41Å; L290-I389 HydrophobicContact CD1-CG2 3.94Å; F384-I389 HydrophobicContact CD2-CD1 4.19Å; F384-I389 HydrophobicContact CD2-CG1 4.22Å; T386-I389 WeakPolarHBondContact O-CB 3.41Å; T386-I389 PolarHBondContact O-N 2.8Å; I389-T393 HydrophobicContact CG2-CG2 3.91Å; I389-L396 HydrophobicContact CD1-CD1 3.98Å; I389-L396 HydrophobicContact CD1-CD2 4.08Å; I389-L396 HydrophobicContact CG1-CD1 4.45Å; I389-L396 HydrophobicContact CG2-CD2 4.07Å; I389-V424 HydrophobicContact CG2-CG2 4.08Å; I389-V424 WeakPolarHBondContact O-CG2 3.41Å; I389-L485 HydrophobicContact CD1-CD1 3.78Å; I389-L485 HydrophobicContact CD1-CD2 3.68Å; I389-L485 HydrophobicContact CD1-CG 4.41Å; I389-L485 HydrophobicContact CG2-CD2 4.4Å
390	A	93.1	Very high	96.4	Very high	52 Å²	52	33.7 Å²	33.7	43%	0.43	20%	0.201	S	C	.	.			trans	-50.8	133.1	-171.7	0	0	0	0	0	112.6	G392 T393	A390-G392 PolarHBondContact O-N 3.16Å; A390-T393 WeakPolarHBondContact O-CB 3.42Å; A390-T393 PolarHBondContact O-N 3.16Å; A390-T393 PolarHBondContact O-OG1 3.07Å
391	P	92.8	Very high	96.3	Very high	83 Å²	83	37.4 Å²	37.4	54%	0.539	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	135.4	176.3	-28.4	35.5	0	0	0	112.4	K288 V424	K288-P391 HydrophobicContact CD-CG 4.46Å; P391-V424 HydrophobicContact CB-CG1 4.37Å; P391-V424 HydrophobicContact CG-CG1 4.37Å
392	G	92.8	Very high	96.2	Very high	66 Å²	66	38.2 Å²	38.2	68%	0.68	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.9	-5.8	-170.9	0	0	0	0	0	115	A390 T394	A390-G392 PolarHBondContact O-N 3.16Å; G392-T394 PolarHBondContact O-N 2.99Å
393	T	96.1	Very high	96.1	Very high	31 Å²	31	38.6 Å²	38.6	19%	0.19	23%	0.232	C	C	.	.			trans	-63.5	121.2	168.6	-58.4	0	0	0	0	110.1	I389 A390 L396 V422	I389-T393 HydrophobicContact CG2-CG2 3.91Å; A390-T393 WeakPolarHBondContact O-CB 3.42Å; A390-T393 PolarHBondContact O-N 3.16Å; A390-T393 PolarHBondContact O-OG1 3.07Å; T393-L396 HydrophobicContact CG2-CD2 3.7Å; T393-V422 HydrophobicContact CG2-CG2 4.35Å
394	T	96.9	Very high	96	Very high	90 Å²	90	38.6 Å²	38.6	55%	0.552	23%	0.232	S	C	*	.			trans	-104.5	-14.8	177.7	52.8	0	0	0	0	113.7	G392 V422	G392-T394 PolarHBondContact O-N 2.99Å; T394-V422 WeakPolarHBondContact CA-O 3.19Å; T394-V422 PolarHBondContact O-N 3.27Å
395	M	97.1	Very high	95.8	Very high	113 Å²	113	39.6 Å²	39.6	56%	0.557	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-145.3	130.2	-173.3	-168.4	-176.7	-62.7	0	0	111.9	I419 L420	M395-I419 HydrophobicContact CE-CG2 4.5Å; M395-I419 HydrophobicContact CG-CG2 3.41Å; M395-I419 VanDerWaalsContact CG-CG2 3.41Å; M395-I419 HydrophobicContact SD-CD1 4.44Å; M395-I419 HydrophobicContact SD-CG2 3.74Å; M395-L420 WeakPolarHBondContact CA-O 3.34Å
396	L	97.9	Very high	95.7	Very high	7 Å²	7	41.2 Å²	41.2	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.3	168.4	-54	178.3	0	0	0	109.1	F384 I389 T393 F398 I419 L420 V422 L485	F384-L396 HydrophobicContact CE2-CD1 4.38Å; F384-L396 HydrophobicContact CZ-CD1 4.38Å; I389-L396 HydrophobicContact CD1-CD1 3.98Å; I389-L396 HydrophobicContact CD1-CD2 4.08Å; I389-L396 HydrophobicContact CG1-CD1 4.45Å; I389-L396 HydrophobicContact CG2-CD2 4.07Å; T393-L396 HydrophobicContact CG2-CD2 3.7Å; L396-F398 HydrophobicContact CB-CE2 3.65Å; L396-F398 HydrophobicContact CB-CZ 4.13Å; L396-I419 CarbonylContact O-C 3.55Å; L396-I419 WeakPolarHBondContact O-CA 3.29Å; L396-L420 HydrophobicContact CB-CB 4.22Å; L396-L420 HydrophobicContact CD1-CD1 4.33Å; L396-L420 PolarHBondContact N-O 2.92Å; L396-L420 PolarHBondContact O-N 3.41Å; L396-V422 HydrophobicContact CD1-CG1 4.32Å; L396-V422 HydrophobicContact CG-CG1 4.41Å; L396-V422 HydrophobicContact CG-CG2 4.07Å; L396-L485 HydrophobicContact CD2-CD1 4.32Å; L396-L485 HydrophobicContact CD2-CD2 3.8Å; L396-L485 HydrophobicContact CD2-CG 4.37Å
397	K	97.8	Very high	95.6	Very high	98 Å²	98	43.6 Å²	43.6	43%	0.426	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.2	176.5	-178.7	178.6	175.9	-173.4	0	110.2	N399 V418 I419	K397-N399 VanDerWaalsContact CE-OD1 3.28Å; K397-N399 WeakPolarHBondContact CE-OD1 3.43Å; K397-V418 WeakPolarHBondContact CA-O 3.32Å; K397-I419 HydrophobicContact CB-CG1 4.46Å; K397-I419 HydrophobicContact CG-CG1 4.24Å
398	F	98.2	Very high	95.5	Very high	6 Å²	6	45.4 Å²	45.4	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.3	176	-57.5	-90.7	0	0	0	109	I382 F384 L396 E402 L403 H417 V418 L420	I382-F398 HydrophobicContact CD1-CB 4.26Å; I382-F398 HydrophobicContact CD1-CD2 3.78Å; I382-F398 HydrophobicContact CD1-CE2 4.32Å; I382-F398 HydrophobicContact CD1-CG 4.05Å; I382-F398 HydrophobicContact CG2-CD1 3.96Å; I382-F398 HydrophobicContact CG2-CD2 4.11Å; I382-F398 HydrophobicContact CG2-CE1 3.68Å; I382-F398 HydrophobicContact CG2-CE2 3.84Å; I382-F398 HydrophobicContact CG2-CG 4.16Å; I382-F398 HydrophobicContact CG2-CZ 3.62Å; F384-F398 HydrophobicContact CD1-CZ 4.46Å; L396-F398 HydrophobicContact CB-CE2 3.65Å; L396-F398 HydrophobicContact CB-CZ 4.13Å; F398-E402 HydrophobicContact CB-CB 4.38Å; F398-E402 HydrophobicContact CD1-CB 4.46Å; F398-L403 HydrophobicContact CB-CD2 3.69Å; F398-H417 CarbonylContact O-C 3.53Å; F398-H417 VanDerWaalsContact O-CA 3.27Å; F398-H417 WeakPolarHBondContact O-CA 3.09Å; F398-H417 WeakPolarHBondContact O-CB 3.37Å; F398-V418 PolarHBondContact N-O 3.07Å; F398-V418 PolarHBondContact O-N 3.26Å; F398-L420 HydrophobicContact CE2-CD1 4.08Å; F398-L420 HydrophobicContact CE2-CG 4.36Å
399	N	97	Very high	95.4	Very high	58 Å²	58	48.4 Å²	48.4	31%	0.31	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	161.2	174.8	-52.3	-79	0	0	0	109.8	K397 P401 E402	K397-N399 VanDerWaalsContact CE-OD1 3.28Å; K397-N399 WeakPolarHBondContact CE-OD1 3.43Å; N399-P401 VanDerWaalsContact C-N 3.31Å; N399-P401 VanDerWaalsContact O-N 3.07Å; N399-E402 WeakPolarHBondContact CB-OE2 3.19Å; N399-E402 PolarHBondContact N-OE2 2.72Å; N399-E402 PolarHBondContact ND2-OE2 2.77Å; N399-E402 WeakPolarHBondContact O-CA 3.35Å; N399-E402 WeakPolarHBondContact O-CB 3.48Å; N399-E402 PolarHBondContact O-N 3.21Å
400	K	95.2	Very high	95.3	Very high	49 Å²	49	55 Å²	55	21%	0.213	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-47.5	-38.6	-177	-176.6	169.4	169.9	62.2	0	116.1	E402 L403 C406 Y412 F416	K400-E402 PolarHBondContact O-N 2.96Å; K400-L403 PolarHBondContact O-N 3.22Å; K400-C406 PolarHBondContact NZ-SG 2.87Å; K400-Y412 HydrophobicContact CD-CD1 4Å; K400-Y412 HydrophobicContact CD-CD2 4.4Å; K400-Y412 HydrophobicContact CD-CG 3.79Å; K400-F416 HydrophobicContact CB-CB 4.37Å; K400-F416 HydrophobicContact CB-CD1 4.26Å; K400-F416 WeakPolarHBondContact CB-O 3.27Å; K400-F416 PolarHBondContact N-O 3.02Å
401	P	94.9	Very high	95.4	Very high	79 Å²	79	54.2 Å²	54.2	51%	0.513	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-64.9	-15.2	175.7	-23	35.4	0	0	0	115.1	P265 N399	P265-P401 WeakPolarHBondContact CG-O 3.39Å; N399-P401 VanDerWaalsContact C-N 3.31Å; N399-P401 VanDerWaalsContact O-N 3.07Å
402	E	95.3	Very high	95.7	Very high	27 Å²	27	51.2 Å²	51.2	13%	0.126	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-100.9	1.9	-176	-52.6	178.5	75.4	0	0	113.4	P265 R269 F398 N399 K400 P483	P265-E402 WeakPolarHBondContact CB-O 3.24Å; R269-E402 PolarHBondContact NH2-O 2.85Å; R269-E402 VanDerWaalsContact NH2-O 3.13Å; F398-E402 HydrophobicContact CB-CB 4.38Å; F398-E402 HydrophobicContact CD1-CB 4.46Å; N399-E402 WeakPolarHBondContact CB-OE2 3.19Å; N399-E402 PolarHBondContact N-OE2 2.72Å; N399-E402 PolarHBondContact ND2-OE2 2.77Å; N399-E402 WeakPolarHBondContact O-CA 3.35Å; N399-E402 WeakPolarHBondContact O-CB 3.48Å; N399-E402 PolarHBondContact O-N 3.21Å; K400-E402 PolarHBondContact O-N 2.96Å; E402-P483 WeakPolarHBondContact OE1-CD 3.4Å; E402-P483 VanDerWaalsContact OE1-CG 3.26Å; E402-P483 WeakPolarHBondContact OE1-CG 3.48Å
403	L	96.8	Very high	95.8	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.047	27%	0.273	C	S	.	.			trans	-98.5	134.8	-178.7	-57.5	-179.2	0	0	0	111	F380 I382 F398 K400 F416 V418	F380-L403 HydrophobicContact CB-CB 4.13Å; F380-L403 HydrophobicContact CB-CD1 4.02Å; F380-L403 HydrophobicContact CD1-CD1 4.41Å; F380-L403 HydrophobicContact CD2-CD2 4.39Å; F380-L403 HydrophobicContact CG-CD1 4.18Å; I382-L403 HydrophobicContact CD1-CD2 3.68Å; I382-L403 HydrophobicContact CG1-CD2 3.55Å; F398-L403 HydrophobicContact CB-CD2 3.69Å; K400-L403 PolarHBondContact O-N 3.22Å; L403-F416 HydrophobicContact CD1-CD1 3.88Å; L403-F416 HydrophobicContact CD1-CE1 3.54Å; L403-V418 HydrophobicContact CD1-CG2 3.93Å; L403-V418 HydrophobicContact CD2-CB 4.33Å; L403-V418 HydrophobicContact CD2-CG2 3.94Å
404	D	95.6	Very high	95.7	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-82.5	169.4	172.5	-43.5	-52.7	0	0	0	111.4	W264 P265 S266 F380 Q381 C406	W264-D404 HydrophobicContact CB-CB 4.35Å; W264-D404 WeakPolarHBondContact CB-OD1 3.29Å; W264-D404 HydrophobicContact CD2-CB 4.13Å; W264-D404 HydrophobicContact CE3-CB 3.59Å; W264-D404 HydrophobicContact CG-CB 4.5Å; W264-D404 HydrophobicContact CZ3-CB 4.07Å; P265-D404 WeakPolarHBondContact CD-OD1 3.48Å; S266-D404 WeakPolarHBondContact CB-OD1 3.38Å; S266-D404 WeakPolarHBondContact CB-OD2 3.45Å; S266-D404 PolarHBondContact N-OD1 3.05Å; S266-D404 PolarHBondContact OG-OD1 2.82Å; S266-D404 VanDerWaalsContact OG-OD1 3.12Å; S266-D404 PolarHBondContact OG-OD2 3.31Å; F380-D404 WeakPolarHBondContact CA-O 3.23Å; Q381-D404 HydrophobicContact CB-CB 4.03Å; Q381-D404 HydrophobicContact CG-CB 4.39Å; Q381-D404 PolarHBondContact N-O 2.79Å; Q381-D404 WeakPolarHBondContact O-CB 3.3Å; Q381-D404 PolarHBondContact O-N 3.15Å; D404-C406 PolarHBondContact O-N 3.4Å
405	A	93.9	Very high	95.6	Very high	20 Å²	20	60 Å²	60	17%	0.165	32%	0.317	C	S	.	.	S	Bend	trans	50.4	31	169.8	0	0	0	0	0	115.3	W264 Q378 Q381	W264-A405 HydrophobicContact CH2-CB 3.92Å; W264-A405 HydrophobicContact CZ3-CB 4.18Å; Q378-A405 HydrophobicContact CG-CB 4.14Å; Q381-A405 HydrophobicContact CB-CB 4Å
406	C	94.9	Very high	95.6	Very high	48 Å²	48	54.8 Å²	54.8	32%	0.324	29%	0.291	S	S	.	.			trans	-68.5	139.1	173.6	-81	0	0	0	0	111.7	K400 D404 Y412	K400-C406 PolarHBondContact NZ-SG 2.87Å; D404-C406 PolarHBondContact O-N 3.4Å; C406-Y412 VanDerWaalsContact CA-OH 3.31Å; C406-Y412 WeakPolarHBondContact CA-OH 3.46Å; C406-Y412 HydrophobicContact CB-CE2 4.47Å
407	D	94.3	Very high	95.6	Very high	52 Å²	52	56.1 Å²	56.1	28%	0.278	30%	0.297	S	S	.	.			trans	-78.1	-175.3	167.2	-156.8	-24.1	0	0	0	110.4	F303 K411 Y412	F303-D407 HydrophobicContact CE1-CB 3.72Å; F303-D407 WeakPolarHBondContact CE1-OD2 3.21Å; F303-D407 HydrophobicContact CZ-CB 3.62Å; D407-K411 HydrophobicContact CB-CD 3.97Å; D407-K411 VanDerWaalsContact CG-CD 3.5Å; D407-K411 IonicContact OD1-NZ 3.87Å; D407-K411 PolarHBondContact OD1-NZ 3.25Å; D407-K411 WeakPolarHBondContact OD2-CD 3.48Å; D407-K411 IonicContact OD2-NZ 3.79Å; D407-K411 PolarHBondContact OD2-NZ 2.91Å; D407-Y412 HydrophobicContact CB-CE2 4.3Å; D407-Y412 PolarHBondContact N-OH 3.21Å; D407-Y412 WeakPolarHBondContact O-CE2 3.26Å
408	S	93.3	Very high	95.7	Very high	41 Å²	41	51.5 Å²	51.5	29%	0.287	28%	0.277	S	S	.	.			trans	-53.6	138.8	-176.6	82	0	0	0	0	112.9	E410 K411 Y412	S408-E410 WeakPolarHBondContact CB-OE2 3.41Å; S408-E410 PolarHBondContact O-N 2.92Å; S408-E410 VanDerWaalsContact O-N 3.13Å; S408-E410 PolarHBondContact OG-OE2 3.23Å; S408-K411 WeakPolarHBondContact O-CB 3.27Å; S408-K411 PolarHBondContact O-N 2.79Å; S408-K411 VanDerWaalsContact O-N 3.09Å; S408-K411 WeakPolarHBondContact OG-CE 3.34Å; S408-Y412 WeakPolarHBondContact O-CD2 3.46Å; S408-Y412 WeakPolarHBondContact O-CE2 3.39Å
409	P	93	Very high	95.7	Very high	87 Å²	87	53 Å²	53	57%	0.565	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-64.8	-25.1	-164.8	24.9	-33.8	0	0	0	113.7	K411 Y412	P409-K411 PolarHBondContact O-N 3.31Å; P409-Y412 PolarHBondContact O-N 3.38Å
410	E	94.2	Very high	95.8	Very high	139 Å²	139	50.2 Å²	50.2	65%	0.65	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-68.9	-14.1	179.4	-35.7	71.6	-156.3	0	0	112.7	S408	S408-E410 WeakPolarHBondContact CB-OE2 3.41Å; S408-E410 PolarHBondContact O-N 2.92Å; S408-E410 VanDerWaalsContact O-N 3.13Å; S408-E410 PolarHBondContact OG-OE2 3.23Å
411	K	96.3	Very high	95.9	Very high	35 Å²	35	51.1 Å²	51.1	15%	0.152	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-79	-6.2	172.6	-65.4	166.2	-178	171.1	0	112.7	P301 C302 F303 D407 S408 P409	P301-K411 WeakPolarHBondContact CB-O 3.46Å; C302-K411 PolarHBondContact N-O 2.83Å; F303-K411 HydrophobicContact CD2-CB 4.21Å; F303-K411 HydrophobicContact CE1-CD 4.27Å; F303-K411 HydrophobicContact CE2-CB 3.81Å; F303-K411 HydrophobicContact CZ-CB 4.22Å; F303-K411 HydrophobicContact CZ-CD 4.24Å; D407-K411 HydrophobicContact CB-CD 3.97Å; D407-K411 VanDerWaalsContact CG-CD 3.5Å; D407-K411 IonicContact OD1-NZ 3.87Å; D407-K411 PolarHBondContact OD1-NZ 3.25Å; D407-K411 WeakPolarHBondContact OD2-CD 3.48Å; D407-K411 IonicContact OD2-NZ 3.79Å; D407-K411 PolarHBondContact OD2-NZ 2.91Å; S408-K411 WeakPolarHBondContact O-CB 3.27Å; S408-K411 PolarHBondContact O-N 2.79Å; S408-K411 VanDerWaalsContact O-N 3.09Å; S408-K411 WeakPolarHBondContact OG-CE 3.34Å; P409-K411 PolarHBondContact O-N 3.31Å
412	Y	97.3	Very high	96.1	Very high	19 Å²	19	47.3 Å²	47.3	8%	0.075	25%	0.252	C	S	.	.	S	Bend	trans	-117.3	133.7	-174.7	-58.7	-101.1	0	0	0	111.1	P301 F303 I379 K400 C406 D407 S408 P409 F416	P301-Y412 HydrophobicContact CB-CD1 4.47Å; F303-Y412 HydrophobicContact CE2-CE1 4.26Å; F303-Y412 HydrophobicContact CE2-CE2 4.22Å; F303-Y412 AromaticContact CE2-CZ 3.92Å; F303-Y412 HydrophobicContact CZ-CE1 4.49Å; F303-Y412 HydrophobicContact CZ-CE2 4.14Å; F303-Y412 AromaticContact CZ-CZ 3.79Å; F303-Y412 WeakPolarHBondContact CZ-OH 3.43Å; I379-Y412 HydrophobicContact CG2-CE1 4.28Å; I379-Y412 WeakPolarHBondContact O-CE1 3.37Å; I379-Y412 PolarHBondContact O-OH 3.16Å; K400-Y412 HydrophobicContact CD-CD1 4Å; K400-Y412 HydrophobicContact CD-CD2 4.4Å; K400-Y412 HydrophobicContact CD-CG 3.79Å; C406-Y412 VanDerWaalsContact CA-OH 3.31Å; C406-Y412 WeakPolarHBondContact CA-OH 3.46Å; C406-Y412 HydrophobicContact CB-CE2 4.47Å; D407-Y412 HydrophobicContact CB-CE2 4.3Å; D407-Y412 PolarHBondContact N-OH 3.21Å; D407-Y412 WeakPolarHBondContact O-CE2 3.26Å; S408-Y412 WeakPolarHBondContact O-CD2 3.46Å; S408-Y412 WeakPolarHBondContact O-CE2 3.39Å; P409-Y412 PolarHBondContact O-N 3.38Å; Y412-F416 AromaticContact CD1-CD1 3.66Å; Y412-F416 HydrophobicContact CD1-CD1 3.66Å; Y412-F416 AromaticContact CD1-CE1 3.86Å; Y412-F416 HydrophobicContact CD1-CE1 3.86Å; Y412-F416 HydrophobicContact CD1-CG 4.06Å; Y412-F416 HydrophobicContact CD1-CZ 4.44Å; Y412-F416 HydrophobicContact CE1-CD1 4.27Å; Y412-F416 HydrophobicContact CE1-CE1 4.06Å
413	P	95.4	Very high	96.1	Very high	36 Å²	36	50.7 Å²	50.7	23%	0.234	27%	0.268	C	S	.	.			trans	-66.7	159.8	171.5	27.6	-34	0	0	0	111.5	P299 F416	P299-P413 HydrophobicContact CB-CB 3.97Å; P299-P413 HydrophobicContact CB-CG 3.67Å; P299-P413 HydrophobicContact CG-CB 4.05Å; P299-P413 HydrophobicContact CG-CG 3.98Å; P413-F416 HydrophobicContact CG-CB 4.24Å; P413-F416 HydrophobicContact CG-CD2 4.1Å; P413-F416 WeakPolarHBondContact O-CB 3.27Å; P413-F416 PolarHBondContact O-N 3.14Å
414	Q	93.9	Very high	96.1	Very high	181 Å²	181	51 Å²	51	85%	0.846	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	147.3	168.6	-64.7	-176	4.6	0	0	110.4	F416	Q414-F416 PolarHBondContact O-N 3.27Å; Q414-F416 VanDerWaalsContact O-N 3.14Å
415	L	95.1	Very high	95.9	Very high	155 Å²	155	53.6 Å²	53.6	81%	0.812	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	24.7	-177.6	-51.7	178	0	0	0	114.5	H417	L415-H417 PolarHBondContact O-N 2.9Å; L415-H417 PolarHBondContact O-ND1 3.21Å
416	F	97.9	Very high	95.5	Very high	3 Å²	3	55.6 Å²	55.6	1%	0.013	31%	0.305	C	S	.	.			trans	-55.6	125.9	172.4	-177.1	-104	0	0	0	111.3	M297 S298 P299 P301 F380 K400 L403 Y412 P413 Q414 V418	M297-F416 HydrophobicContact CB-CE2 4.12Å; M297-F416 HydrophobicContact CB-CZ 4.15Å; M297-F416 HydrophobicContact CG-CE2 4.1Å; M297-F416 HydrophobicContact CG-CZ 4.42Å; M297-F416 HydrophobicContact SD-CE2 4.32Å; M297-F416 HydrophobicContact SD-CZ 4.35Å; S298-F416 WeakPolarHBondContact O-CA 3.3Å; P299-F416 WeakPolarHBondContact O-CD2 3.04Å; P299-F416 VanDerWaalsContact O-CE2 3.3Å; P299-F416 WeakPolarHBondContact O-CE2 3.08Å; P301-F416 HydrophobicContact CB-CE2 4.28Å; P301-F416 HydrophobicContact CG-CE2 4.07Å; P301-F416 HydrophobicContact CG-CZ 4.39Å; F380-F416 HydrophobicContact CD1-CE1 4.1Å; F380-F416 HydrophobicContact CD1-CZ 4.04Å; F380-F416 HydrophobicContact CE1-CZ 4.1Å; K400-F416 HydrophobicContact CB-CB 4.37Å; K400-F416 HydrophobicContact CB-CD1 4.26Å; K400-F416 WeakPolarHBondContact CB-O 3.27Å; K400-F416 PolarHBondContact N-O 3.02Å; L403-F416 HydrophobicContact CD1-CD1 3.88Å; L403-F416 HydrophobicContact CD1-CE1 3.54Å; Y412-F416 AromaticContact CD1-CD1 3.66Å; Y412-F416 HydrophobicContact CD1-CD1 3.66Å; Y412-F416 AromaticContact CD1-CE1 3.86Å; Y412-F416 HydrophobicContact CD1-CE1 3.86Å; Y412-F416 HydrophobicContact CD1-CG 4.06Å; Y412-F416 HydrophobicContact CD1-CZ 4.44Å; Y412-F416 HydrophobicContact CE1-CD1 4.27Å; Y412-F416 HydrophobicContact CE1-CE1 4.06Å; P413-F416 HydrophobicContact CG-CB 4.24Å; P413-F416 HydrophobicContact CG-CD2 4.1Å; P413-F416 WeakPolarHBondContact O-CB 3.27Å; P413-F416 PolarHBondContact O-N 3.14Å; Q414-F416 PolarHBondContact O-N 3.27Å; Q414-F416 VanDerWaalsContact O-N 3.14Å; F416-V418 HydrophobicContact CE1-CG2 4.23Å; F416-V418 HydrophobicContact CZ-CG2 4.31Å
417	H	98	Very high	95.1	Very high	36 Å²	36	58.8 Å²	58.8	17%	0.167	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	160.5	179.5	62.6	-80.5	0	0	0	111.3	S298 F398 L415	S298-H417 PolarHBondContact N-O 3.48Å; S298-H417 PolarHBondContact O-CE1 3.4Å; S298-H417 PolarHBondContact O-N 2.81Å; S298-H417 PolarHBondContact O-ND1 2.96Å; S298-H417 VanDerWaalsContact O-ND1 3.11Å; F398-H417 CarbonylContact O-C 3.53Å; F398-H417 VanDerWaalsContact O-CA 3.27Å; F398-H417 WeakPolarHBondContact O-CA 3.09Å; F398-H417 WeakPolarHBondContact O-CB 3.37Å; L415-H417 PolarHBondContact O-N 2.9Å; L415-H417 PolarHBondContact O-ND1 3.21Å
418	V	98.6	Very high	94.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.8	177.8	-176.3	0	0	0	0	108.1	L295 T296 F380 I382 K397 F398 L403 F416	L295-V418 HydrophobicContact CD1-CG1 3.96Å; L295-V418 HydrophobicContact CD2-CG1 4.07Å; L295-V418 HydrophobicContact CG-CG1 3.86Å; T296-V418 CarbonylContact O-C 3.54Å; T296-V418 WeakPolarHBondContact O-CA 3.42Å; F380-V418 HydrophobicContact CD1-CG2 3.99Å; F380-V418 HydrophobicContact CD2-CG2 4.27Å; F380-V418 HydrophobicContact CE1-CG2 3.5Å; F380-V418 HydrophobicContact CE2-CB 4.48Å; F380-V418 HydrophobicContact CE2-CG1 3.98Å; F380-V418 HydrophobicContact CE2-CG2 3.82Å; F380-V418 HydrophobicContact CG-CG2 4.36Å; F380-V418 HydrophobicContact CZ-CB 4.23Å; F380-V418 HydrophobicContact CZ-CG1 3.74Å; F380-V418 HydrophobicContact CZ-CG2 3.4Å; I382-V418 HydrophobicContact CD1-CB 4.01Å; I382-V418 HydrophobicContact CD1-CG1 3.76Å; I382-V418 HydrophobicContact CD1-CG2 4.45Å; K397-V418 WeakPolarHBondContact CA-O 3.32Å; F398-V418 PolarHBondContact N-O 3.07Å; F398-V418 PolarHBondContact O-N 3.26Å; L403-V418 HydrophobicContact CD1-CG2 3.93Å; L403-V418 HydrophobicContact CD2-CB 4.33Å; L403-V418 HydrophobicContact CD2-CG2 3.94Å; F416-V418 HydrophobicContact CE1-CG2 4.23Å; F416-V418 HydrophobicContact CZ-CG2 4.31Å
419	I	98.6	Very high	93.9	Very high	37 Å²	37	62 Å²	62	19%	0.19	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.9	175.6	-56.5	179.9	0	0	0	108.3	L295 T296 M395 L396 K397	L295-I419 CarbonylContact C-O 3.43Å; L295-I419 WeakPolarHBondContact CA-O 3.21Å; T296-I419 PolarHBondContact N-O 3.01Å; T296-I419 PolarHBondContact O-N 2.89Å; M395-I419 HydrophobicContact CE-CG2 4.5Å; M395-I419 HydrophobicContact CG-CG2 3.41Å; M395-I419 VanDerWaalsContact CG-CG2 3.41Å; M395-I419 HydrophobicContact SD-CD1 4.44Å; M395-I419 HydrophobicContact SD-CG2 3.74Å; L396-I419 CarbonylContact O-C 3.55Å; L396-I419 WeakPolarHBondContact O-CA 3.29Å; K397-I419 HydrophobicContact CB-CG1 4.46Å; K397-I419 HydrophobicContact CG-CG1 4.24Å
420	L	98.6	Very high	93	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.6	163.7	-51.4	178.9	0	0	0	108	I292 A294 L295 F384 M395 L396 F398 V422	I292-L420 HydrophobicContact CG2-CB 4.47Å; I292-L420 HydrophobicContact CG2-CD2 4.46Å; A294-L420 WeakPolarHBondContact O-CA 3.41Å; L295-L420 HydrophobicContact CB-CD2 3.93Å; L295-L420 HydrophobicContact CD1-CD2 3.69Å; L295-L420 HydrophobicContact CG-CD2 3.82Å; F384-L420 HydrophobicContact CE1-CD1 3.64Å; F384-L420 HydrophobicContact CZ-CD1 4.04Å; M395-L420 WeakPolarHBondContact CA-O 3.34Å; L396-L420 HydrophobicContact CB-CB 4.22Å; L396-L420 HydrophobicContact CD1-CD1 4.33Å; L396-L420 PolarHBondContact N-O 2.92Å; L396-L420 PolarHBondContact O-N 3.41Å; F398-L420 HydrophobicContact CE2-CD1 4.08Å; F398-L420 HydrophobicContact CE2-CG 4.36Å; L420-V422 HydrophobicContact CB-CG1 3.75Å
421	D	98.3	Very high	91.9	Very high	68 Å²	68	63.9 Å²	63.9	36%	0.364	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	122.6	163.1	173.5	24.4	0	0	0	107.5	K293 A294	K293-D421 HydrophobicContact CB-CB 4.21Å; K293-D421 VanDerWaalsContact CB-OD2 3.28Å; K293-D421 WeakPolarHBondContact CB-OD2 3.49Å; K293-D421 WeakPolarHBondContact CD-OD1 3.47Å; K293-D421 WeakPolarHBondContact CD-OD2 3.39Å; K293-D421 PolarHBondContact N-O 2.84Å; A294-D421 HydrophobicContact CB-CB 4.36Å; A294-D421 PolarHBondContact N-O 2.9Å; A294-D421 PolarHBondContact O-N 3.41Å
422	V	98.1	Very high	90.7	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	168	-167.6	-61	0	0	0	0	112.7	L290 V291 I292 T393 T394 L396 L420	L290-V422 HydrophobicContact CD1-CB 4.01Å; L290-V422 HydrophobicContact CD1-CG2 4.27Å; L290-V422 HydrophobicContact CD2-CB 4.41Å; L290-V422 HydrophobicContact CD2-CG1 4.19Å; L290-V422 HydrophobicContact CG-CB 4.23Å; L290-V422 HydrophobicContact CG-CG1 4.48Å; V291-V422 CarbonylContact O-C 3.47Å; V291-V422 WeakPolarHBondContact O-CA 3.4Å; I292-V422 HydrophobicContact CG1-CG1 4.39Å; I292-V422 HydrophobicContact CG2-CG1 4.44Å; T393-V422 HydrophobicContact CG2-CG2 4.35Å; T394-V422 WeakPolarHBondContact CA-O 3.19Å; T394-V422 PolarHBondContact O-N 3.27Å; L396-V422 HydrophobicContact CD1-CG1 4.32Å; L396-V422 HydrophobicContact CG-CG1 4.41Å; L396-V422 HydrophobicContact CG-CG2 4.07Å; L420-V422 HydrophobicContact CB-CG1 3.75Å
423	E	96.8	Very high	89.8	Confident	98 Å²	98	74.7 Å²	74.7	46%	0.458	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	126.4	169.7	-168.5	168.4	139	0	0	110.1	L290 V291 K293	L290-E423 CarbonylContact C-O 3.56Å; L290-E423 WeakPolarHBondContact CA-O 3.36Å; V291-E423 HydrophobicContact CB-CB 4.46Å; V291-E423 PolarHBondContact N-O 2.89Å; V291-E423 PolarHBondContact O-N 3.18Å; K293-E423 WeakPolarHBondContact CE-OE2 3.47Å; K293-E423 IonicContact NZ-OE2 3.5Å; K293-E423 PolarHBondContact NZ-OE2 3.16Å
424	V	95.4	Very high	89	Confident	16 Å²	16	78 Å²	78	10%	0.097	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	117.8	171.8	-177.1	0	0	0	0	108	K288 L290 I389 P391	K288-V424 HydrophobicContact CB-CG1 3.83Å; K288-V424 HydrophobicContact CD-CG1 4.33Å; L290-V424 HydrophobicContact CD1-CB 4.43Å; L290-V424 HydrophobicContact CD1-CG2 3.59Å; I389-V424 HydrophobicContact CG2-CG2 4.08Å; I389-V424 WeakPolarHBondContact O-CG2 3.41Å; P391-V424 HydrophobicContact CB-CG1 4.37Å; P391-V424 HydrophobicContact CG-CG1 4.37Å
425	E	91.4	Very high	88.6	Confident	54 Å²	54	70.1 Å²	70.1	25%	0.252	38%	0.377	S	S	.	.			trans	-61.7	142.6	-179.7	-69.9	176.3	-149.9	0	0	110.5	K288 P289 V291 S350 V427	K288-E425 WeakPolarHBondContact CD-O 3.27Å; P289-E425 HydrophobicContact CB-CB 4.36Å; P289-E425 HydrophobicContact CB-CG 4.22Å; P289-E425 HydrophobicContact CG-CB 4.48Å; P289-E425 WeakPolarHBondContact CG-OE2 3.26Å; P289-E425 PolarHBondContact O-N 2.83Å; V291-E425 HydrophobicContact CG2-CG 3.95Å; V291-E425 WeakPolarHBondContact CG2-OE1 3.45Å; S350-E425 WeakPolarHBondContact CB-OE1 3.31Å; S350-E425 PolarHBondContact OG-OE1 3.18Å; E425-V427 PolarHBondContact O-N 3.13Å
426	G	86.9	Confident	88.3	Confident	62 Å²	62	63.7 Å²	63.7	64%	0.639	34%	0.344	S	S	*	.	S	Bend	trans	-65.9	-24.1	-174.3	0	0	0	0	0	114.7	K288	K288-G426 PolarHBondContact NZ-O 2.86Å
427	V	85.7	Confident	87.8	Confident	115 Å²	115	64.8 Å²	64.8	70%	0.697	35%	0.348	S	S	*	.	S	Bend	trans	-110	136.8	-170.5	-175.5	0	0	0	0	110.4	P289 E425	P289-V427 VanDerWaalsContact CD-O 3.29Å; P289-V427 WeakPolarHBondContact CD-O 3.45Å; E425-V427 PolarHBondContact O-N 3.13Å
428	D	82.6	Confident	87	Confident	71 Å²	71	66.1 Å²	66.1	38%	0.38	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-71.9	130.7	171.6	-76	-90.8	0	0	0	111.2	S287 K288	S287-D428 VanDerWaalsContact CA-OD1 3.23Å; S287-D428 WeakPolarHBondContact CA-OD1 3.5Å; S287-D428 WeakPolarHBondContact CB-OD1 3.47Å; S287-D428 PolarHBondContact N-OD1 3.21Å; S287-D428 PolarHBondContact OG-OD1 2.77Å; K288-D428 VanDerWaalsContact CE-OD2 3.26Å; K288-D428 WeakPolarHBondContact CE-OD2 3.14Å; K288-D428 WeakPolarHBondContact CG-OD1 3.48Å; K288-D428 WeakPolarHBondContact CG-OD2 3.42Å; K288-D428 PolarHBondContact N-OD1 3.32Å
429	K	79.9	Confident	85.8	Confident	89 Å²	89	75.5 Å²	75.5	39%	0.387	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-74.4	147.6	167.4	-87.3	-178.1	-166.4	148.6	0	110	P289 S350 Q352	P289-K429 HydrophobicContact CB-CD 4.49Å; P289-K429 HydrophobicContact CG-CB 4.1Å; P289-K429 HydrophobicContact CG-CD 3.48Å; P289-K429 VanDerWaalsContact CG-CD 3.48Å; P289-K429 VanDerWaalsContact CG-CE 3.48Å; P289-K429 HydrophobicContact CG-CG 3.55Å; S350-K429 PolarHBondContact OG-NZ 2.92Å; Q352-K429 VanDerWaalsContact OE1-CB 3.29Å
430	Q	74.3	Confident	84.9	Confident	170 Å²	170	75.1 Å²	75.1	79%	0.794	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-55.8	139.2	173.2	-171.1	177	-62.4	0	0	110.3
431	K	70.5	Confident	83.9	Confident	97 Å²	97	78.7 Å²	78.7	42%	0.422	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-86.8	119.7	177.2	-64.1	173.1	-179.2	171.6	0	109.4	S287 L433 E438	S287-K431 WeakPolarHBondContact OG-CE 3.32Å; K431-L433 VanDerWaalsContact C-N 3.28Å; K431-E438 IonicContact NZ-OE1 2.63Å; K431-E438 PolarHBondContact NZ-OE1 2.76Å
432	D	70.9	Confident	82.9	Confident	150 Å²	150	76.8 Å²	76.8	80%	0.802	41%	0.41	S	S	*	.	S	Bend	trans	-71	-25.7	174.5	-62.1	-44.1	0	0	0	112.6
433	L	78.1	Confident	81.7	Confident	130 Å²	130	86.8 Å²	86.8	68%	0.681	45%	0.453	S	S	*	.	S	Bend	trans	-138.8	137.5	179.3	-66.6	174.4	0	0	0	110.8	K431 P435	K431-L433 VanDerWaalsContact C-N 3.28Å; L433-P435 WeakPolarHBondContact O-CD 3.47Å
434	T	79.9	Confident	81	Confident	106 Å²	106	86.5 Å²	86.5	65%	0.65	46%	0.455	S	S	*	.			trans	-65.3	119.2	166.8	-57.2	0	0	0	0	109.6	E438	T434-E438 HydrophobicContact CG2-CB 4.13Å
435	P	85.8	Confident	80.8	Confident	16 Å²	16	86.6 Å²	86.6	10%	0.104	46%	0.455	C	S	.	.			trans	-75.2	153.2	179.9	31.8	-36.7	0	0	0	112.3	L433 W437 E438	L433-P435 WeakPolarHBondContact O-CD 3.47Å; P435-W437 HydrophobicContact CB-CD2 3.76Å; P435-W437 HydrophobicContact CB-CE3 4.11Å; P435-W437 HydrophobicContact CB-CG 4.43Å; P435-W437 HydrophobicContact CB-CH2 3.86Å; P435-W437 HydrophobicContact CB-CZ2 3.43Å; P435-W437 VanDerWaalsContact CB-CZ2 3.43Å; P435-W437 HydrophobicContact CB-CZ3 4.18Å; P435-W437 HydrophobicContact CG-CD2 4.3Å; P435-W437 HydrophobicContact CG-CZ2 3.98Å; P435-W437 PolarHBondContact O-N 2.82Å; P435-W437 VanDerWaalsContact O-N 3.07Å; P435-E438 VanDerWaalsContact CD-CD 3.5Å; P435-E438 WeakPolarHBondContact CD-OE1 3.26Å; P435-E438 HydrophobicContact CG-CG 3.93Å; P435-E438 WeakPolarHBondContact CG-OE1 3.14Å; P435-E438 PolarHBondContact O-N 2.84Å
436	P	86.9	Confident	80.7	Confident	20 Å²	20	86.4 Å²	86.4	13%	0.13	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.1	-167.4	29.6	-38	0	0	0	115	F201 A202 K205	F201-P436 HydrophobicContact CB-CG 4.22Å; F201-P436 HydrophobicContact CD1-CB 4.06Å; F201-P436 HydrophobicContact CD1-CG 3.93Å; F201-P436 WeakPolarHBondContact CE1-O 3.28Å; F201-P436 HydrophobicContact CG-CG 4.47Å; A202-P436 HydrophobicContact CB-CB 4.27Å; A202-P436 HydrophobicContact CB-CG 4.18Å; K205-P436 PolarHBondContact NZ-O 3.11Å
437	W	88.4	Confident	81	Confident	26 Å²	26	84.6 Å²	84.6	10%	0.098	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-17	174.1	53.1	82.9	0	0	0	113.8	L197 F201 M277 P285 P435 Q439 F440	L197-W437 HydrophobicContact CB-CH2 4.47Å; L197-W437 HydrophobicContact CB-CZ3 4.49Å; L197-W437 HydrophobicContact CD2-CH2 4.06Å; L197-W437 HydrophobicContact CD2-CZ3 4.31Å; L197-W437 HydrophobicContact CG-CH2 4.09Å; L197-W437 HydrophobicContact CG-CZ3 3.94Å; F201-W437 HydrophobicContact CB-CE3 4.05Å; F201-W437 HydrophobicContact CB-CZ3 4.4Å; F201-W437 HydrophobicContact CD1-CB 4.13Å; F201-W437 HydrophobicContact CD1-CE3 4.38Å; F201-W437 HydrophobicContact CD2-CB 4.35Å; F201-W437 HydrophobicContact CD2-CE3 4.47Å; F201-W437 HydrophobicContact CE1-CB 3.73Å; F201-W437 HydrophobicContact CE2-CB 3.96Å; F201-W437 HydrophobicContact CG-CB 4.43Å; F201-W437 HydrophobicContact CG-CE3 4.06Å; F201-W437 HydrophobicContact CZ-CB 3.63Å; M277-W437 HydrophobicContact CE-CB 3.74Å; M277-W437 HydrophobicContact CE-CD2 3.26Å; M277-W437 HydrophobicContact CE-CE3 3.25Å; M277-W437 HydrophobicContact CE-CG 3.52Å; M277-W437 HydrophobicContact CE-CH2 4.49Å; M277-W437 HydrophobicContact CE-CZ3 3.89Å; P285-W437 HydrophobicContact CG-CH2 4.32Å; P285-W437 HydrophobicContact CG-CZ2 3.41Å; P285-W437 VanDerWaalsContact CG-CZ2 3.41Å; P435-W437 HydrophobicContact CB-CD2 3.76Å; P435-W437 HydrophobicContact CB-CE3 4.11Å; P435-W437 HydrophobicContact CB-CG 4.43Å; P435-W437 HydrophobicContact CB-CH2 3.86Å; P435-W437 HydrophobicContact CB-CZ2 3.43Å; P435-W437 VanDerWaalsContact CB-CZ2 3.43Å; P435-W437 HydrophobicContact CB-CZ3 4.18Å; P435-W437 HydrophobicContact CG-CD2 4.3Å; P435-W437 HydrophobicContact CG-CZ2 3.98Å; P435-W437 PolarHBondContact O-N 2.82Å; P435-W437 VanDerWaalsContact O-N 3.07Å; W437-Q439 PolarHBondContact O-N 2.92Å; W437-F440 WeakPolarHBondContact O-CB 3.33Å; W437-F440 PolarHBondContact O-N 3.03Å
438	E	81.9	Confident	81.4	Confident	63 Å²	63	82.6 Å²	82.6	29%	0.294	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	131.6	170.3	-80.5	173.2	-154.8	0	0	109.3	K431 T434 P435 F440	K431-E438 IonicContact NZ-OE1 2.63Å; K431-E438 PolarHBondContact NZ-OE1 2.76Å; T434-E438 HydrophobicContact CG2-CB 4.13Å; P435-E438 VanDerWaalsContact CD-CD 3.5Å; P435-E438 WeakPolarHBondContact CD-OE1 3.26Å; P435-E438 HydrophobicContact CG-CG 3.93Å; P435-E438 WeakPolarHBondContact CG-OE1 3.14Å; P435-E438 PolarHBondContact O-N 2.84Å; E438-F440 PolarHBondContact O-N 3.38Å
439	Q	72.7	Confident	82	Confident	197 Å²	197	80 Å²	80	92%	0.921	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	21.1	-176	-49.2	175.4	12.3	0	0	115	W437 P441	W437-Q439 PolarHBondContact O-N 2.92Å; Q439-P441 WeakPolarHBondContact O-CD 3.37Å
440	F	80.6	Confident	82.8	Confident	29 Å²	29	75.8 Å²	75.8	13%	0.127	40%	0.396	C	S	.	.			trans	-81.8	123.5	175.6	-175.4	-106.6	0	0	0	112.6	F201 K205 F240 W437 E438 C442 L445	F201-F440 HydrophobicContact CE1-CB 4.33Å; F201-F440 HydrophobicContact CE1-CD1 4.26Å; F201-F440 HydrophobicContact CE1-CG 4.1Å; F201-F440 HydrophobicContact CZ-CB 4.28Å; F201-F440 AromaticContact CZ-CD1 3.72Å; F201-F440 HydrophobicContact CZ-CD1 3.72Å; F201-F440 HydrophobicContact CZ-CE1 4.28Å; F201-F440 AromaticContact CZ-CG 3.99Å; F201-F440 HydrophobicContact CZ-CG 3.99Å; K205-F440 HydrophobicContact CD-CD2 3.99Å; K205-F440 HydrophobicContact CD-CE2 4.22Å; K205-F440 HydrophobicContact CG-CD2 4.25Å; K205-F440 HydrophobicContact CG-CE2 3.96Å; F240-F440 HydrophobicContact CE1-CE1 4.44Å; F240-F440 HydrophobicContact CE1-CZ 4.01Å; F240-F440 HydrophobicContact CE2-CE1 4.29Å; F240-F440 HydrophobicContact CE2-CZ 4.42Å; F240-F440 AromaticContact CZ-CE1 3.79Å; F240-F440 HydrophobicContact CZ-CE1 3.79Å; F240-F440 HydrophobicContact CZ-CE2 4.23Å; F240-F440 AromaticContact CZ-CZ 3.51Å; F240-F440 HydrophobicContact CZ-CZ 3.51Å; W437-F440 WeakPolarHBondContact O-CB 3.33Å; W437-F440 PolarHBondContact O-N 3.03Å; E438-F440 PolarHBondContact O-N 3.38Å; F440-C442 PolarHBondContact O-N 3.07Å; F440-L445 HydrophobicContact CE1-CD1 4.08Å; F440-L445 HydrophobicContact CE1-CD2 4.22Å; F440-L445 HydrophobicContact CE1-CG 4.32Å; F440-L445 HydrophobicContact CZ-CD2 4.03Å
441	P	76.8	Confident	83.8	Confident	76 Å²	76	68.2 Å²	68.2	49%	0.494	36%	0.361	S	S	.	.			trans	-85.3	92.8	-179	33.1	-33.9	0	0	0	112	Q439 K443 D444	Q439-P441 WeakPolarHBondContact O-CD 3.37Å; P441-K443 PolarHBondContact O-N 3.26Å; P441-K443 VanDerWaalsContact O-N 3.11Å; P441-D444 PolarHBondContact O-N 3.07Å
442	C	76.3	Confident	85	Confident	27 Å²	27	67.6 Å²	67.6	18%	0.182	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-60.2	-22.2	178.9	-55.5	0	0	0	0	114.1	F440 D444 L445	F440-C442 PolarHBondContact O-N 3.07Å; C442-D444 PolarHBondContact O-N 2.66Å; C442-D444 VanDerWaalsContact O-N 3.08Å; C442-L445 HydrophobicContact CB-CD1 4.02Å; C442-L445 VanDerWaalsContact O-CB 3.3Å; C442-L445 WeakPolarHBondContact O-CB 3.4Å; C442-L445 WeakPolarHBondContact O-CD1 3.46Å; C442-L445 VanDerWaalsContact O-CG 3.27Å; C442-L445 WeakPolarHBondContact O-CG 3.26Å; C442-L445 PolarHBondContact O-N 2.8Å
443	K	74.6	Confident	86	Confident	210 Å²	210	62.3 Å²	62.3	91%	0.913	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-60.8	-19.2	-179.9	-61	-172.2	178.9	-173	0	114.5	P441 L445	P441-K443 PolarHBondContact O-N 3.26Å; P441-K443 VanDerWaalsContact O-N 3.11Å; K443-L445 VanDerWaalsContact C-N 3.35Å
444	D	82.3	Confident	86.6	Confident	93 Å²	93	62.4 Å²	62.4	50%	0.497	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-87.5	-2.2	-177.4	-99.5	51.2	0	0	0	114.1	K212 P441 C442	K212-D444 PolarHBondContact NZ-O 2.6Å; K212-D444 IonicContact NZ-OD2 2.61Å; K212-D444 PolarHBondContact NZ-OD2 3.05Å; P441-D444 PolarHBondContact O-N 3.07Å; C442-D444 PolarHBondContact O-N 2.66Å; C442-D444 VanDerWaalsContact O-N 3.08Å
445	L	90	Very high	87.2	Confident	17 Å²	17	61.5 Å²	61.5	9%	0.089	34%	0.335	C	S	.	.			trans	-83.8	132.9	-175.8	-64.7	169.7	0	0	0	111.4	F240 H242 V278 F440 C442 K443	F240-L445 HydrophobicContact CD1-CD2 3.83Å; F240-L445 HydrophobicContact CE1-CD2 3.6Å; F240-L445 HydrophobicContact CZ-CD2 4.38Å; F240-L445 WeakPolarHBondContact O-CD1 3.44Å; F240-L445 WeakPolarHBondContact O-CD2 3.3Å; H242-L445 VanDerWaalsContact CD2-CB 3.49Å; H242-L445 WeakPolarHBondContact CD2-CB 3.33Å; V278-L445 HydrophobicContact CB-CD1 3.89Å; V278-L445 HydrophobicContact CG1-CD1 4.06Å; F440-L445 HydrophobicContact CE1-CD1 4.08Å; F440-L445 HydrophobicContact CE1-CD2 4.22Å; F440-L445 HydrophobicContact CE1-CG 4.32Å; F440-L445 HydrophobicContact CZ-CD2 4.03Å; C442-L445 HydrophobicContact CB-CD1 4.02Å; C442-L445 VanDerWaalsContact O-CB 3.3Å; C442-L445 WeakPolarHBondContact O-CB 3.4Å; C442-L445 WeakPolarHBondContact O-CD1 3.46Å; C442-L445 VanDerWaalsContact O-CG 3.27Å; C442-L445 WeakPolarHBondContact O-CG 3.26Å; C442-L445 PolarHBondContact O-N 2.8Å; K443-L445 VanDerWaalsContact C-N 3.35Å
446	S	90.3	Very high	87.5	Confident	50 Å²	50	62.7 Å²	62.7	35%	0.35	34%	0.339	S	S	.	.			trans	-146.3	138.7	175.8	-178.4	0	0	0	0	111	C241 S448 V449	C241-S446 CarbonylContact O-C 3.58Å; C241-S446 VanDerWaalsContact O-C 3.22Å; S446-S448 WeakPolarHBondContact CB-OG 3.4Å; S446-S448 PolarHBondContact O-N 3.39Å; S446-S448 PolarHBondContact OG-OG 3.15Å; S446-V449 VanDerWaalsContact O-CG1 3.29Å; S446-V449 WeakPolarHBondContact O-CG1 3.47Å; S446-V449 PolarHBondContact O-N 3.02Å
447	P	93.6	Very high	87.8	Confident	25 Å²	25	63.3 Å²	63.3	16%	0.162	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-66.4	-22.7	179.1	25.4	-34	0	0	0	112.1	C241 L243 V449 L450 F451	C241-P447 VanDerWaalsContact O-CA 3.23Å; C241-P447 WeakPolarHBondContact O-CA 3.44Å; C241-P447 VanDerWaalsContact O-CD 3.26Å; C241-P447 WeakPolarHBondContact O-CD 3.2Å; L243-P447 HydrophobicContact CB-CB 4.02Å; L243-P447 HydrophobicContact CD1-CB 4.07Å; P447-V449 PolarHBondContact O-N 3.41Å; P447-V449 VanDerWaalsContact O-N 3.1Å; P447-L450 VanDerWaalsContact O-CB 3.32Å; P447-L450 WeakPolarHBondContact O-CB 3.43Å; P447-L450 WeakPolarHBondContact O-CG 3.49Å; P447-L450 PolarHBondContact O-N 3.2Å; P447-F451 WeakPolarHBondContact O-CD2 3.26Å; P447-F451 WeakPolarHBondContact O-CE2 3.48Å
448	S	93	Very high	87.9	Confident	73 Å²	73	66.8 Å²	66.8	51%	0.51	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-53.5	-29.5	175.6	62.7	0	0	0	0	113.7	S446 L450 F451	S446-S448 WeakPolarHBondContact CB-OG 3.4Å; S446-S448 PolarHBondContact O-N 3.39Å; S446-S448 PolarHBondContact OG-OG 3.15Å; S448-L450 PolarHBondContact O-N 3.16Å; S448-F451 PolarHBondContact O-N 2.97Å
449	V	95.3	Very high	88.3	Confident	17 Å²	17	66.8 Å²	66.8	10%	0.103	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-65.8	-20.1	-179.8	84.4	0	0	0	0	113	R131 L211 C241 S446 P447	R131-V449 PolarHBondContact NH1-O 3.14Å; L211-V449 HydrophobicContact CB-CG2 3.8Å; C241-V449 HydrophobicContact CB-CG1 4.35Å; S446-V449 VanDerWaalsContact O-CG1 3.29Å; S446-V449 WeakPolarHBondContact O-CG1 3.47Å; S446-V449 PolarHBondContact O-N 3.02Å; P447-V449 PolarHBondContact O-N 3.41Å; P447-V449 VanDerWaalsContact O-N 3.1Å
450	L	96.5	Very high	89.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-81.4	-14.5	-178.4	-54.2	170.1	0	0	0	113.5	T129 I132 M237 F238 C241 L243 P447 S448	T129-L450 VanDerWaalsContact CB-O 3.27Å; T129-L450 WeakPolarHBondContact CB-O 3.4Å; T129-L450 PolarHBondContact OG1-O 3.4Å; I132-L450 HydrophobicContact CD1-CD2 3.7Å; M237-L450 HydrophobicContact CE-CD2 4Å; M237-L450 HydrophobicContact CG-CD2 3.92Å; F238-L450 HydrophobicContact CD1-CD1 3.88Å; F238-L450 HydrophobicContact CE1-CD1 4.43Å; C241-L450 HydrophobicContact CB-CD1 4.01Å; C241-L450 HydrophobicContact CB-CD2 4.04Å; C241-L450 HydrophobicContact CB-CG 4.05Å; L243-L450 HydrophobicContact CB-CD1 3.88Å; L243-L450 HydrophobicContact CD2-CD1 3.94Å; L243-L450 HydrophobicContact CG-CD1 4.46Å; P447-L450 VanDerWaalsContact O-CB 3.32Å; P447-L450 WeakPolarHBondContact O-CB 3.43Å; P447-L450 WeakPolarHBondContact O-CG 3.49Å; P447-L450 PolarHBondContact O-N 3.2Å; S448-L450 PolarHBondContact O-N 3.16Å
451	F	96.4	Very high	89.5	Confident	10 Å²	10	59.8 Å²	59.8	4%	0.044	33%	0.33	C	S	.	.			trans	-126.5	162.7	-168.3	-53.2	-76.8	0	0	0	111.5	T129 R131 L243 P447 S448 E456 H457 A460	T129-F451 HydrophobicContact CG2-CD1 3.9Å; T129-F451 HydrophobicContact CG2-CE1 3.6Å; T129-F451 HydrophobicContact CG2-CZ 4.42Å; R131-F451 WeakPolarHBondContact CD-O 3.3Å; L243-F451 HydrophobicContact CD1-CE2 3.93Å; L243-F451 HydrophobicContact CD1-CZ 3.89Å; L243-F451 HydrophobicContact CD2-CE2 4.37Å; L243-F451 HydrophobicContact CD2-CZ 3.8Å; P447-F451 WeakPolarHBondContact O-CD2 3.26Å; P447-F451 WeakPolarHBondContact O-CE2 3.48Å; S448-F451 PolarHBondContact O-N 2.97Å; F451-E456 HydrophobicContact CB-CB 4.41Å; F451-E456 HydrophobicContact CD1-CB 4.23Å; F451-E456 HydrophobicContact CD1-CG 3.81Å; F451-H457 HydrophobicContact CD2-CB 3.64Å; F451-H457 AromaticContact CD2-CD2 3.94Å; F451-H457 AromaticContact CD2-CG 3.89Å; F451-H457 HydrophobicContact CE2-CB 3.85Å; F451-H457 AromaticContact CE2-CD2 3.31Å; F451-H457 WeakPolarHBondContact CE2-CD2 3.28Å; F451-H457 AromaticContact CE2-CG 3.75Å; F451-H457 HydrophobicContact CG-CB 4.04Å; F451-H457 HydrophobicContact CZ-CB 4.39Å; F451-H457 AromaticContact CZ-CD2 3.89Å; F451-A460 HydrophobicContact CE1-CB 3.68Å; F451-A460 HydrophobicContact CZ-CB 3.83Å
452	S	94.1	Very high	90	Very high	85 Å²	85	58.4 Å²	58.4	59%	0.594	33%	0.325	S	S	*	.	S	Bend	trans	-101.7	-8.2	176.3	-55.9	0	0	0	0	113.1	S130 R131 E456	S130-S452 WeakPolarHBondContact CB-OG 3.41Å; S130-S452 VanDerWaalsContact OG-CB 3.29Å; S130-S452 WeakPolarHBondContact OG-CB 3.21Å; S130-S452 PolarHBondContact OG-N 3.43Å; S130-S452 PolarHBondContact OG-OG 3.36Å; R131-S452 WeakPolarHBondContact CG-OG 3.36Å; S452-E456 PolarHBondContact N-OE2 2.86Å
453	G	91.8	Very high	90.3	Very high	38 Å²	38	59.5 Å²	59.5	39%	0.392	33%	0.328	S	S	.	.	S	Bend	trans	-159.9	154.9	178.3	0	0	0	0	0	112.8	Q455 E456	G453-Q455 VanDerWaalsContact C-N 3.33Å; G453-Q455 PolarHBondContact O-N 3.47Å; G453-E456 WeakPolarHBondContact O-CB 3.14Å; G453-E456 PolarHBondContact O-N 3.23Å
454	H	91.4	Very high	90.3	Very high	132 Å²	132	49.7 Å²	49.7	61%	0.611	29%	0.287	S	S	*	.	H	α-helix	trans	-65.5	-32.2	-174.6	-173.3	83.1	0	0	0	113.7	H457 Q458	H454-H457 WeakPolarHBondContact O-CB 3.48Å; H454-H457 PolarHBondContact O-N 3.39Å; H454-Q458 PolarHBondContact CD2-NE2 3.44Å; H454-Q458 PolarHBondContact NE2-NE2 3.44Å; H454-Q458 PolarHBondContact O-N 2.95Å
455	Q	92	Very high	89.6	Confident	88 Å²	88	47 Å²	47	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-58.9	-47.6	174.3	-174.9	71.5	70.3	0	0	111.1	G453 H457 Q458 D459	G453-Q455 VanDerWaalsContact C-N 3.33Å; G453-Q455 PolarHBondContact O-N 3.47Å; Q455-H457 PolarHBondContact O-N 3.49Å; Q455-Q458 WeakPolarHBondContact O-CB 3.48Å; Q455-Q458 PolarHBondContact O-N 2.93Å; Q455-D459 PolarHBondContact NE2-OD1 2.86Å; Q455-D459 PolarHBondContact O-N 3.46Å; Q455-D459 VanDerWaalsContact O-OD1 3.13Å
456	E	93.7	Very high	88.1	Confident	41 Å²	41	51 Å²	51	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-58.5	-35.8	-178.8	-166	-164.9	169.3	0	0	112.4	T129 S130 F451 S452 G453 A460	T129-E456 WeakPolarHBondContact CA-OE1 3.48Å; T129-E456 WeakPolarHBondContact CB-OE1 3.41Å; S130-E456 WeakPolarHBondContact CB-OE1 3.22Å; S130-E456 WeakPolarHBondContact CB-OE2 3.28Å; S130-E456 PolarHBondContact N-OE1 2.97Å; S130-E456 VanDerWaalsContact OG-CD 3.24Å; S130-E456 PolarHBondContact OG-OE1 3.27Å; S130-E456 VanDerWaalsContact OG-OE1 3.1Å; S130-E456 PolarHBondContact OG-OE2 3.09Å; F451-E456 HydrophobicContact CB-CB 4.41Å; F451-E456 HydrophobicContact CD1-CB 4.23Å; F451-E456 HydrophobicContact CD1-CG 3.81Å; S452-E456 PolarHBondContact N-OE2 2.86Å; G453-E456 WeakPolarHBondContact O-CB 3.14Å; G453-E456 PolarHBondContact O-N 3.23Å; E456-A460 WeakPolarHBondContact O-CB 3.47Å; E456-A460 PolarHBondContact O-N 3.08Å
457	H	91.6	Very high	86.5	Confident	33 Å²	33	51.8 Å²	51.8	15%	0.153	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-45.1	174.4	179.7	-150.1	0	0	0	111.9	F451 H454 Q455 A460 L461	F451-H457 HydrophobicContact CD2-CB 3.64Å; F451-H457 AromaticContact CD2-CD2 3.94Å; F451-H457 AromaticContact CD2-CG 3.89Å; F451-H457 HydrophobicContact CE2-CB 3.85Å; F451-H457 AromaticContact CE2-CD2 3.31Å; F451-H457 WeakPolarHBondContact CE2-CD2 3.28Å; F451-H457 AromaticContact CE2-CG 3.75Å; F451-H457 HydrophobicContact CG-CB 4.04Å; F451-H457 HydrophobicContact CZ-CB 4.39Å; F451-H457 AromaticContact CZ-CD2 3.89Å; H454-H457 WeakPolarHBondContact O-CB 3.48Å; H454-H457 PolarHBondContact O-N 3.39Å; Q455-H457 PolarHBondContact O-N 3.49Å; H457-A460 PolarHBondContact O-N 3.4Å; H457-L461 WeakPolarHBondContact O-CG 3.35Å; H457-L461 PolarHBondContact O-N 2.66Å; H457-L461 VanDerWaalsContact O-N 3.12Å
458	Q	91.1	Very high	84.5	Confident	98 Å²	98	54.5 Å²	54.5	46%	0.458	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-44	174.7	-65.8	-171.7	11.6	0	0	111.6	H454 Q455 A460 L461 A462	H454-Q458 PolarHBondContact CD2-NE2 3.44Å; H454-Q458 PolarHBondContact NE2-NE2 3.44Å; H454-Q458 PolarHBondContact O-N 2.95Å; Q455-Q458 WeakPolarHBondContact O-CB 3.48Å; Q455-Q458 PolarHBondContact O-N 2.93Å; Q458-A460 VanDerWaalsContact C-N 3.31Å; Q458-A460 PolarHBondContact O-N 2.88Å; Q458-L461 PolarHBondContact O-N 2.87Å; Q458-A462 WeakPolarHBondContact O-CB 3.49Å; Q458-A462 PolarHBondContact O-N 2.94Å
459	D	89.6	Confident	82.4	Confident	64 Å²	64	58.4 Å²	58.4	34%	0.342	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-40	179.2	-56.7	-13.9	0	0	0	111	Q455 A462 I463	Q455-D459 PolarHBondContact NE2-OD1 2.86Å; Q455-D459 PolarHBondContact O-N 3.46Å; Q455-D459 VanDerWaalsContact O-OD1 3.13Å; D459-A462 PolarHBondContact O-N 3.22Å; D459-I463 WeakPolarHBondContact O-CD1 3.2Å; D459-I463 VanDerWaalsContact O-CG1 3.27Å; D459-I463 WeakPolarHBondContact O-CG1 3.36Å; D459-I463 PolarHBondContact O-N 3.43Å
460	A	89.9	Confident	80.2	Confident	7 Å²	7	62.5 Å²	62.5	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-65.6	-38.9	176	0	0	0	0	0	113.1	L253 F451 E456 H457 Q458 A464	L253-A460 HydrophobicContact CD1-CB 4.27Å; L253-A460 HydrophobicContact CD2-CB 3.97Å; F451-A460 HydrophobicContact CE1-CB 3.68Å; F451-A460 HydrophobicContact CZ-CB 3.83Å; E456-A460 WeakPolarHBondContact O-CB 3.47Å; E456-A460 PolarHBondContact O-N 3.08Å; H457-A460 PolarHBondContact O-N 3.4Å; Q458-A460 VanDerWaalsContact C-N 3.31Å; Q458-A460 PolarHBondContact O-N 2.88Å; A460-A464 PolarHBondContact O-N 2.93Å
461	L	89.1	Confident	77.7	Confident	72 Å²	72	68.1 Å²	68.1	38%	0.377	38%	0.375	S	S	.	.	H	α-helix	trans	-67.5	-41.6	173	-68.9	173	0	0	0	111.4	L243 F244 H457 Q458 A464 G465	L243-L461 HydrophobicContact CD1-CD2 3.83Å; L243-L461 HydrophobicContact CD1-CG 4.3Å; F244-L461 HydrophobicContact CD1-CD2 4.46Å; F244-L461 HydrophobicContact CE1-CD2 3.86Å; H457-L461 WeakPolarHBondContact O-CG 3.35Å; H457-L461 PolarHBondContact O-N 2.66Å; H457-L461 VanDerWaalsContact O-N 3.12Å; Q458-L461 PolarHBondContact O-N 2.87Å; L461-A464 PolarHBondContact O-N 3.16Å; L461-G465 PolarHBondContact O-N 2.87Å
462	A	86.8	Confident	74.8	Confident	46 Å²	46	72.6 Å²	72.6	38%	0.38	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-42.4	177.7	0	0	0	0	0	112.2	Q458 D459 A464 G465 I466	Q458-A462 WeakPolarHBondContact O-CB 3.49Å; Q458-A462 PolarHBondContact O-N 2.94Å; D459-A462 PolarHBondContact O-N 3.22Å; A462-A464 VanDerWaalsContact C-N 3.32Å; A462-A464 PolarHBondContact O-N 3.36Å; A462-G465 PolarHBondContact O-N 3.47Å; A462-I466 WeakPolarHBondContact O-CB 3.45Å; A462-I466 WeakPolarHBondContact O-CD1 3.41Å; A462-I466 VanDerWaalsContact O-CG1 3.25Å; A462-I466 WeakPolarHBondContact O-CG1 3.44Å; A462-I466 PolarHBondContact O-N 3.48Å
463	I	83.4	Confident	72.2	Confident	51 Å²	51	71.9 Å²	71.9	26%	0.262	39%	0.393	S	S	.	.	H	α-helix	trans	-57.9	-43.7	175.4	-71.9	163.3	0	0	0	111.3	L253 A256 D459 Q467	L253-I463 HydrophobicContact CD1-CB 4.1Å; L253-I463 HydrophobicContact CD1-CD1 4.38Å; L253-I463 HydrophobicContact CD1-CG2 3.82Å; A256-I463 HydrophobicContact CB-CG2 3.61Å; D459-I463 WeakPolarHBondContact O-CD1 3.2Å; D459-I463 VanDerWaalsContact O-CG1 3.27Å; D459-I463 WeakPolarHBondContact O-CG1 3.36Å; D459-I463 PolarHBondContact O-N 3.43Å; I463-Q467 PolarHBondContact O-N 3.27Å
464	A	74.6	Confident	69.6	Low	4 Å²	4	73.8 Å²	73.8	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-68.7	-43.2	176.6	0	0	0	0	0	112.3	F244 P249 A460 L461 A462 Q467 M468	F244-A464 HydrophobicContact CE1-CB 3.67Å; F244-A464 HydrophobicContact CZ-CB 3.67Å; P249-A464 HydrophobicContact CB-CB 4.28Å; A460-A464 PolarHBondContact O-N 2.93Å; L461-A464 PolarHBondContact O-N 3.16Å; A462-A464 VanDerWaalsContact C-N 3.32Å; A462-A464 PolarHBondContact O-N 3.36Å; A464-Q467 PolarHBondContact O-N 3.31Å; A464-M468 PolarHBondContact O-N 2.81Å
465	G	67.3	Low	67.1	Low	37 Å²	37	77.1 Å²	77.1	38%	0.381	41%	0.408	S	S	.	.	H	α-helix	trans	-64.6	-41.1	179.7	0	0	0	0	0	113.9	L461 A462 M468	L461-G465 PolarHBondContact O-N 2.87Å; A462-G465 PolarHBondContact O-N 3.47Å; G465-M468 WeakPolarHBondContact O-CB 3.42Å; G465-M468 PolarHBondContact O-N 3.38Å
466	I	59.7	Low	64.7	Low	101 Å²	101	76 Å²	76	52%	0.518	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-43.2	176.1	-68.4	164	0	0	0	110.3	A462 M468 L469 V470	A462-I466 WeakPolarHBondContact O-CB 3.45Å; A462-I466 WeakPolarHBondContact O-CD1 3.41Å; A462-I466 VanDerWaalsContact O-CG1 3.25Å; A462-I466 WeakPolarHBondContact O-CG1 3.44Å; A462-I466 PolarHBondContact O-N 3.48Å; I466-M468 VanDerWaalsContact C-N 3.26Å; I466-M468 PolarHBondContact O-N 3.25Å; I466-L469 PolarHBondContact O-N 3.39Å; I466-V470 HydrophobicContact CG2-CG2 4.29Å; I466-V470 PolarHBondContact O-N 3Å; I466-V470 VanDerWaalsContact O-N 3.12Å
467	Q	55	Low	62	Low	66 Å²	66	80.3 Å²	80.3	31%	0.308	42%	0.421	S	S	.	.	H	α-helix	trans	-64.9	-30.2	-179.5	-153.6	72.3	-6.7	0	0	112.7	Q252 I463 A464 L469 F471	Q252-Q467 HydrophobicContact CB-CB 4.32Å; Q252-Q467 HydrophobicContact CB-CG 4.33Å; Q252-Q467 HydrophobicContact CG-CB 4.43Å; Q252-Q467 HydrophobicContact CG-CG 4.21Å; I463-Q467 PolarHBondContact O-N 3.27Å; A464-Q467 PolarHBondContact O-N 3.31Å; Q467-L469 VanDerWaalsContact C-N 3.29Å; Q467-L469 PolarHBondContact O-N 2.97Å; Q467-F471 HydrophobicContact CG-CD2 4.04Å; Q467-F471 HydrophobicContact CG-CE2 4.37Å; Q467-F471 WeakPolarHBondContact O-CB 3.43Å; Q467-F471 PolarHBondContact O-N 3.41Å; Q467-F471 VanDerWaalsContact O-N 3.12Å
468	M	52.8	Low	59.3	Low	82 Å²	82	85.7 Å²	85.7	40%	0.404	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-22.6	173	-77.6	-68.2	-63.5	0	0	114.2	Q252 A464 G465 I466	Q252-M468 PolarHBondContact NE2-SD 3.44Å; Q252-M468 VanDerWaalsContact NE2-SD 3.42Å; A464-M468 PolarHBondContact O-N 2.81Å; G465-M468 WeakPolarHBondContact O-CB 3.42Å; G465-M468 PolarHBondContact O-N 3.38Å; I466-M468 VanDerWaalsContact C-N 3.26Å; I466-M468 PolarHBondContact O-N 3.25Å
469	L	48.3	Very low	56.7	Low	155 Å²	155	83.3 Å²	83.3	81%	0.812	45%	0.445	S	S	*	.	H	α-helix	trans	-92	-34.1	176.8	-65	174.6	0	0	0	112.4	I466 Q467	I466-L469 PolarHBondContact O-N 3.39Å; Q467-L469 VanDerWaalsContact C-N 3.29Å; Q467-L469 PolarHBondContact O-N 2.97Å
470	V	48.4	Very low	54.2	Low	102 Å²	102	83.8 Å²	83.8	62%	0.618	44%	0.444	S	S	*	.	H	α-helix	trans	-77.7	-31.5	-179.6	177.8	0	0	0	0	112.2	I466	I466-V470 HydrophobicContact CG2-CG2 4.29Å; I466-V470 PolarHBondContact O-N 3Å; I466-V470 VanDerWaalsContact O-N 3.12Å
471	F	45.5	Very low	51.4	Low	119 Å²	119	87.2 Å²	87.2	52%	0.522	47%	0.468	S	S	.	.	S	Bend	trans	-92.4	106.4	177	-82.9	-109.1	0	0	0	111	Q467	Q467-F471 HydrophobicContact CG-CD2 4.04Å; Q467-F471 HydrophobicContact CG-CE2 4.37Å; Q467-F471 WeakPolarHBondContact O-CB 3.43Å; Q467-F471 PolarHBondContact O-N 3.41Å; Q467-F471 VanDerWaalsContact O-N 3.12Å
472	N	34.9	Very low	49	Very low	103 Å²	103	89.4 Å²	89.4	55%	0.551	47%	0.474	S	S	*	.			trans	-49.1	122	179.4	-177.9	-42.8	0	0	0	111.4	C474 Y475	N472-C474 PolarHBondContact O-N 3.13Å; N472-C474 VanDerWaalsContact O-N 3.11Å; N472-C474 WeakPolarHBondContact OD1-CB 3.34Å; N472-C474 PolarHBondContact OD1-N 2.9Å; N472-Y475 PolarHBondContact O-N 3.24Å
473	P	39.3	Very low	46.4	Very low	71 Å²	71	89.5 Å²	89.5	46%	0.461	47%	0.471	S	S	.	.	H	α-helix	trans	-61.8	-26.4	-170.8	22.7	-33.6	0	0	0	113.4	Y475 M476 F477	P473-Y475 VanDerWaalsContact C-N 3.26Å; P473-Y475 PolarHBondContact O-N 2.82Å; P473-M476 PolarHBondContact O-N 3.5Å; P473-M476 VanDerWaalsContact O-N 3.15Å; P473-F477 HydrophobicContact CB-CD2 3.62Å; P473-F477 HydrophobicContact CB-CE2 3.93Å; P473-F477 WeakPolarHBondContact O-CB 3.33Å; P473-F477 WeakPolarHBondContact O-CD2 3.1Å; P473-F477 PolarHBondContact O-N 2.99Å
474	C	37.7	Very low	44.1	Very low	78 Å²	78	92 Å²	92	53%	0.527	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-31.6	-175.8	-65.1	0	0	0	0	113.7	N472 L478	N472-C474 PolarHBondContact O-N 3.13Å; N472-C474 VanDerWaalsContact O-N 3.11Å; N472-C474 WeakPolarHBondContact OD1-CB 3.34Å; N472-C474 PolarHBondContact OD1-N 2.9Å; C474-L478 WeakPolarHBondContact O-CB 3.5Å
475	Y	39	Very low	42.5	Very low	202 Å²	202	94.4 Å²	94.4	79%	0.792	51%	0.505	S	S	*	.	H	α-helix	trans	-79.6	-28.2	178.7	-98.4	-92.1	0	0	0	113.9	N472 P473 S479	N472-Y475 PolarHBondContact O-N 3.24Å; P473-Y475 VanDerWaalsContact C-N 3.26Å; P473-Y475 PolarHBondContact O-N 2.82Å; Y475-S479 WeakPolarHBondContact O-CB 3.49Å; Y475-S479 PolarHBondContact O-OG 3.26Å
476	M	41.1	Very low	40.8	Very low	64 Å²	64	97.1 Å²	97.1	32%	0.315	52%	0.517	S	S	.	.	H	α-helix	trans	-89	-47.7	176.3	-80.4	-67.1	-68.3	0	0	112.3	V248 P473 L478 S479 F480	V248-M476 HydrophobicContact CG1-CE 3.89Å; V248-M476 HydrophobicContact CG2-CE 4.13Å; P473-M476 PolarHBondContact O-N 3.5Å; P473-M476 VanDerWaalsContact O-N 3.15Å; M476-L478 VanDerWaalsContact C-N 3.34Å; M476-L478 PolarHBondContact O-N 2.89Å; M476-S479 PolarHBondContact O-N 3.01Å; M476-F480 HydrophobicContact CE-CD2 3.44Å; M476-F480 VanDerWaalsContact CE-CD2 3.44Å; M476-F480 HydrophobicContact CE-CE2 3.62Å; M476-F480 HydrophobicContact CE-CG 4.14Å; M476-F480 HydrophobicContact CE-CZ 4.45Å; M476-F480 WeakPolarHBondContact O-CB 3.49Å; M476-F480 PolarHBondContact O-N 2.95Å; M476-F480 HydrophobicContact SD-CD2 3.63Å; M476-F480 HydrophobicContact SD-CE2 3.55Å; M476-F480 VanDerWaalsContact SD-CE2 3.55Å
477	F	36.1	Very low	39.5	Very low	131 Å²	131	102.6 Å²	102.6	58%	0.575	53%	0.532	S	S	*	.	H	α-helix	trans	-67.2	-31.1	-173.9	-83.2	-96.6	0	0	0	113.2	P473 S481	P473-F477 HydrophobicContact CB-CD2 3.62Å; P473-F477 HydrophobicContact CB-CE2 3.93Å; P473-F477 WeakPolarHBondContact O-CB 3.33Å; P473-F477 WeakPolarHBondContact O-CD2 3.1Å; P473-F477 PolarHBondContact O-N 2.99Å; F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 3.19Å; F477-S481 VanDerWaalsContact O-N 3.1Å; F477-S481 PolarHBondContact O-OG 2.91Å
478	L	35.5	Very low	38.2	Very low	146 Å²	146	107.2 Å²	107.2	76%	0.764	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-22.4	172.5	-74.7	166	0	0	0	113.2	C474 M476	C474-L478 WeakPolarHBondContact O-CB 3.5Å; M476-L478 VanDerWaalsContact C-N 3.34Å; M476-L478 PolarHBondContact O-N 2.89Å
479	S	36.1	Very low	36.9	Very low	49 Å²	49	110 Å²	110	34%	0.343	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-27	179.5	-53.5	0	0	0	0	113.3	Y475 M476	Y475-S479 WeakPolarHBondContact O-CB 3.49Å; Y475-S479 PolarHBondContact O-OG 3.26Å; M476-S479 PolarHBondContact O-N 3.01Å
480	F	37.1	Very low	35.8	Very low	73 Å²	73	111.5 Å²	111.5	32%	0.32	57%	0.57	S	S	.	*			trans	-121.6	25.6	-177.6	-67.4	-86.9	0	0	0	112.6	M476 F482	M476-F480 HydrophobicContact CE-CD2 3.44Å; M476-F480 VanDerWaalsContact CE-CD2 3.44Å; M476-F480 HydrophobicContact CE-CE2 3.62Å; M476-F480 HydrophobicContact CE-CG 4.14Å; M476-F480 HydrophobicContact CE-CZ 4.45Å; M476-F480 WeakPolarHBondContact O-CB 3.49Å; M476-F480 PolarHBondContact O-N 2.95Å; M476-F480 HydrophobicContact SD-CD2 3.63Å; M476-F480 HydrophobicContact SD-CE2 3.55Å; M476-F480 VanDerWaalsContact SD-CE2 3.55Å; F480-F482 WeakPolarHBondContact O-CD2 3.28Å; F480-F482 PolarHBondContact O-N 2.72Å
481	S	31.5	Very low	34.6	Very low	80 Å²	80	111.9 Å²	111.9	56%	0.559	58%	0.575	S	S	*	*			trans	-66.1	87.7	160.8	-83.4	0	0	0	0	109	F477 P483	F477-S481 WeakPolarHBondContact O-CB 3.49Å; F477-S481 PolarHBondContact O-N 3.19Å; F477-S481 VanDerWaalsContact O-N 3.1Å; F477-S481 PolarHBondContact O-OG 2.91Å; S481-P483 WeakPolarHBondContact O-CD 3.41Å; S481-P483 WeakPolarHBondContact O-CG 3.47Å
482	F	39.3	Very low	33.7	Very low	117 Å²	117	112 Å²	112	51%	0.513	59%	0.585	S	S	.	*			trans	-46	109.3	177.7	-73.1	-94.5	0	0	0	111.2	P247 F480 S484	P247-F482 HydrophobicContact CG-CZ 4.18Å; F480-F482 WeakPolarHBondContact O-CD2 3.28Å; F480-F482 PolarHBondContact O-N 2.72Å; F482-S484 PolarHBondContact O-N 2.93Å
483	P	31.3	Very low	33.2	Very low	49 Å²	49	115.7 Å²	115.7	32%	0.318	60%	0.599	S	S	.	*			trans	-73.1	115.1	-175.6	-19.8	34.1	0	0	0	111.5	E402 S481 L485	E402-P483 WeakPolarHBondContact OE1-CD 3.4Å; E402-P483 VanDerWaalsContact OE1-CG 3.26Å; E402-P483 WeakPolarHBondContact OE1-CG 3.48Å; S481-P483 WeakPolarHBondContact O-CD 3.41Å; S481-P483 WeakPolarHBondContact O-CG 3.47Å; P483-L485 PolarHBondContact O-N 3.42Å
484	S	36.3	Very low	32.5	Very low	104 Å²	104	120.1 Å²	120.1	73%	0.727	61%	0.614	S	S	*	*	S	Bend	trans	56.9	-25.9	160.2	-57	0	0	0	0	120.4	F482 C486 R487	F482-S484 PolarHBondContact O-N 2.93Å; S484-C486 PolarHBondContact O-N 3.38Å; S484-R487 PolarHBondContact O-N 3.25Å
485	L	40.2	Very low	31.9	Very low	53 Å²	53	122.4 Å²	122.4	28%	0.277	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-17	-174.6	-75	175.3	0	0	0	114.7	I389 L396 P483	I389-L485 HydrophobicContact CD1-CD1 3.78Å; I389-L485 HydrophobicContact CD1-CD2 3.68Å; I389-L485 HydrophobicContact CD1-CG 4.41Å; I389-L485 HydrophobicContact CG2-CD2 4.4Å; L396-L485 HydrophobicContact CD2-CD1 4.32Å; L396-L485 HydrophobicContact CD2-CD2 3.8Å; L396-L485 HydrophobicContact CD2-CG 4.37Å; P483-L485 PolarHBondContact O-N 3.42Å
486	C	31.5	Very low	31.1	Very low	94 Å²	94	117.8 Å²	117.8	64%	0.635	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	16.8	178.5	-58.8	0	0	0	0	113.5	S484	S484-C486 PolarHBondContact O-N 3.38Å
487	R	31.7	Very low	30.4	Very low	217 Å²	217	125 Å²	125	82%	0.819	65%	0.649	S	S	*	*			trans	-143.8	98.6	174.6	-87.3	-168.1	173.3	-168.4	-0.8	111.8	S484	S484-R487 PolarHBondContact O-N 3.25Å
488	L	29.3	Very low	29.8	Very low	162 Å²	162	126.5 Å²	126.5	85%	0.848	66%	0.657	S	S	*	*				-165.2	171.4	124	-129.9	70	0	0	0	111.8
489	N	25.5	Very low	29.3	Very low	141 Å²	141	129.2 Å²	129.2	75%	0.754	67%	0.666	S	S	*	*			trans	64.6	66.3	167.6	-62.4	9.7	0	0	0	117.7
490	Y	23.6	Very low	28.7	Very low	186 Å²	186	130.2 Å²	130.2	73%	0.729	68%	0.684	S	S	*	*				-88.9	121.9	122.3	-102.8	-93.8	0	0	0	107.5	K281	K281-Y490 PolarHBondContact NZ-OH 2.89Å
491	P	24.5	Very low	28.1	Very low	111 Å²	111	136.7 Å²	136.7	72%	0.721	72%	0.715	S	S	*	*			trans	-80.6	111.8	162.5	31.1	-28.2	0	0	0	108.6
492	T	25.6	Very low	27.8	Very low	120 Å²	120	136.4 Å²	136.4	74%	0.736	73%	0.725	S	S	*	*			trans	-87.7	104.7	162.6	-56.9	0	0	0	0	107.2	E494	T492-E494 PolarHBondContact O-N 3.16Å
493	E	24	Very low	27	Very low	182 Å²	182	142.8 Å²	142.8	85%	0.85	75%	0.746	S	S	*	*			trans	-75.3	120.2	163.4	-69.2	-162.7	137.7	0	0	108.8	P495	E493-P495 WeakPolarHBondContact O-CD 3.37Å
494	E	24.7	Very low	26.7	Very low	163 Å²	163	144.8 Å²	144.8	76%	0.762	77%	0.766	S	S	*	*			trans	-83.1	111.1	165.7	-84.2	-100	120	0	0	108.9	T492 S496	T492-E494 PolarHBondContact O-N 3.16Å; E494-S496 PolarHBondContact O-N 3Å
495	P	26.5	Very low	26.2	Very low	127 Å²	127	147.7 Å²	147.7	83%	0.825	77%	0.768	S	S	*	*			trans	-77.3	87.2	178.3	31.9	-34.3	0	0	0	110.5	E493 R497	E493-P495 WeakPolarHBondContact O-CD 3.37Å; P495-R497 PolarHBondContact O-N 2.77Å
496	S	22.4	Very low	25.4	Very low	105 Å²	105	149.4 Å²	149.4	73%	0.734	78%	0.784	S	S	*	*			trans	-64.7	110.9	175.7	-63.3	0	0	0	0	112	E494	E494-S496 PolarHBondContact O-N 3Å
497	R	26.5	Very low	25.2	Very low	214 Å²	214	152.3 Å²	152.3	81%	0.808	79%	0.788	S	S	*	*			trans	-166.2	116.7	148.8	-113.1	-176.2	170.5	102.5	2.8	117.4	P495	P495-R497 PolarHBondContact O-N 2.77Å
498	Q	23.8	Very low	24.8	Very low	163 Å²	163	150 Å²	150	76%	0.762	79%	0.786	S	S	*	*			trans	68	137.6	133.6	-71.5	171	-44.8	0	0	122.3
499	H	25	Very low	24.7	Very low	203 Å²	203	147.4 Å²	147.4	94%	0.94	78%	0.782	S	S	*	*			trans	-70	163.8	169.6	-67.8	-17.4	0	0	0	113.3
500	G	23.4	Very low	24.8	Very low	70 Å²	70	149.7 Å²	149.7	72%	0.722	79%	0.788	S	S	*	*			trans	-176.2	42.4	172.5	0	0	0	0	0	119.2
501	E	24.1	Very low	25.5	Very low	209 Å²	209	147 Å²	147	98%	0.977	79%	0.793	S	S	*	*			trans	61.5	159.2	163	-54.1	-171.8	102.9	0	0	119.1
502	G	24.1	Very low	25.7	Very low	75 Å²	75	146.2 Å²	146.2	77%	0.773	79%	0.79	S	S	*	*			trans	-173.8	-59.4	-175.1	0	0	0	0	0	118
503	R	23.5	Very low	26.1	Very low	251 Å²	251	147.2 Å²	147.2	95%	0.947	79%	0.791	S	S	*	*			trans	79.9	154.3	170.1	-156.1	175.6	-172	158.1	3.3	118.9
504	A	24.5	Very low	26.3	Very low	90 Å²	90	146.2 Å²	146.2	74%	0.744	79%	0.792	S	S	*	*			trans	80.8	139.6	168.7	0	0	0	0	0	118.4
505	H	25.1	Very low	26.6	Very low	165 Å²	165	146.4 Å²	146.4	76%	0.764	79%	0.793	S	S	*	*			cis	-166.6	150.5	-21.3	-150.2	-71.8	0	0	0	111.2
506	C	23.3	Very low	26.6	Very low	90 Å²	90	148.2 Å²	148.2	61%	0.608	79%	0.792	S	S	*	*			trans	62.9	134	173.5	-70.9	0	0	0	0	117.2
507	E	27.6	Very low	26.9	Very low	155 Å²	155	150.6 Å²	150.6	72%	0.724	80%	0.796	S	S	*	*			cis	84.3	136.2	48.4	-73.8	169.4	139.3	0	0	112.9
508	E	23.9	Very low	26.9	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	80%	0.795	S	S	*	*			cis	-141.8	146.1	3.8	-105.4	165.6	110.5	0	0	107.8
509	S	27.5	Very low	27.1	Very low	107 Å²	107	145.9 Å²	145.9	75%	0.748	80%	0.8	S	S	*	*				95.8	145.5	57	-59.2	0	0	0	0	114.3
510	E	28.3	Very low	27.2	Very low	189 Å²	189	140.8 Å²	140.8	88%	0.883	79%	0.787	S	S	*	*			trans	-85.5	-178	-177.9	-51.7	179.9	124.3	0	0	112
511	P	37.8	Very low	27.3	Very low	130 Å²	130	142.3 Å²	142.3	84%	0.844	79%	0.786	S	S	*	*				-152.5	-170.5	82.8	41.5	-21.2	0	0	0	116.3
512	S	28.1	Very low	27.6	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	78%	0.775	S	S	*	*			trans	-96.9	170.1	178.8	177.7	0	0	0	0	112.8
513	D	33.8	Very low	27.8	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	78%	0.776	S	S	*	*				147.9	156.7	123.6	-74	-25.2	0	0	0	118.3
514	D	27.8	Very low	27.9	Very low	161 Å²	161	140.5 Å²	140.5	86%	0.861	77%	0.774	S	S	*	*			trans	82.7	154.3	152.2	-84.9	-36.3	0	0	0	124.9
515	E	31.8	Very low	28.4	Very low	167 Å²	167	140.8 Å²	140.8	78%	0.78	77%	0.77	S	S	*	*			trans	-98.9	151	-167.4	-55.8	-174.2	95	0	0	114.6
516	M	27.3	Very low	28.3	Very low	164 Å²	164	140.8 Å²	140.8	81%	0.808	77%	0.774	S	S	*	*				165.2	124.3	110.7	-90.7	-173.5	-80.9	0	0	115.3
517	L	28.6	Very low	28.7	Very low	155 Å²	155	141.5 Å²	141.5	81%	0.812	78%	0.78	S	S	*	*			trans	40.6	113.8	139.2	-57.3	177	0	0	0	121.4
518	S	26.6	Very low	28.9	Very low	115 Å²	115	138.7 Å²	138.7	80%	0.804	78%	0.784	S	S	*	*				-156.8	127.7	126	-87.8	0	0	0	0	114
519	L	26.3	Very low	29.2	Very low	164 Å²	164	135.1 Å²	135.1	86%	0.859	78%	0.783	S	S	*	*			trans	18.6	143.4	138.1	-53	177.9	0	0	0	119.9
520	S	27.4	Very low	29.4	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	78%	0.778	S	S	*	*			cis	-176.4	173.4	-6.5	55.7	0	0	0	0	110.8
521	S	27.1	Very low	29.3	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	78%	0.778	S	S	*	*			trans	50.4	107.3	152.3	-61.6	0	0	0	0	119.8
522	Q	28.5	Very low	28.6	Very low	157 Å²	157	135.5 Å²	135.5	73%	0.734	77%	0.769	S	S	*	*				77.2	125.4	72	-77	-164.6	35	0	0	117.2
523	R	28.4	Very low	29.1	Very low	213 Å²	213	136.8 Å²	136.8	80%	0.804	78%	0.776	S	S	*	*			trans	64	131.3	140.8	-68	178.3	170	-167.2	-2.8	120.7
524	S	26.3	Very low	28.6	Very low	127 Å²	127	137 Å²	137	89%	0.888	77%	0.772	S	S	*	*				-148.4	127.2	125.3	-79.8	0	0	0	0	110
525	S	34.3	Very low	29.6	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	76%	0.763	S	S	*	*			trans	-144.7	144.6	171.7	58	0	0	0	0	109.6	S527	S525-S527 PolarHBondContact O-OG 3.2Å
526	I	24.4	Very low	29.4	Very low	164 Å²	164	130.8 Å²	130.8	84%	0.841	76%	0.763	S	S	*	*			trans	-127.9	114.8	-178.2	-63.1	178	0	0	0	106.3
527	S	31.3	Very low	29.8	Very low	105 Å²	105	127.8 Å²	127.8	73%	0.734	76%	0.764	S	S	*	*			cis	86	145.3	43.5	-64	0	0	0	0	112.7	S525	S525-S527 PolarHBondContact O-OG 3.2Å
528	A	31.8	Very low	30.4	Very low	97 Å²	97	125.8 Å²	125.8	80%	0.802	76%	0.76	S	S	*	*			cis	-148.5	176.2	-6.8	0	0	0	0	0	108.8
529	A	30.4	Very low	30.6	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	76%	0.762	S	S	*	*			cis	-127.8	-121.8	-3.7	0	0	0	0	0	108.5
530	S	30.9	Very low	31.4	Very low	93 Å²	93	125.1 Å²	125.1	65%	0.65	76%	0.761	S	S	*	*			cis	-159.9	162.7	-10.4	-139	0	0	0	0	107.4
531	Q	26.8	Very low	31.5	Very low	186 Å²	186	125.1 Å²	125.1	87%	0.869	77%	0.766	S	S	*	*			cis	-139.2	-121.4	0.5	-157.8	152.2	-59.2	0	0	109.4
532	K	22.7	Very low	31.9	Very low	154 Å²	154	125 Å²	125	67%	0.67	77%	0.771	S	S	*	*			trans	-153	128	174.3	178.4	177.1	173.8	179.4	0	113.9	E534	K532-E534 WeakPolarHBondContact CE-OE2 3.49Å; K532-E534 IonicContact NZ-OE2 2.66Å; K532-E534 PolarHBondContact NZ-OE2 3.14Å
533	P	39.3	Very low	32.1	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	78%	0.776	S	S	*	*			trans	-112.9	177.7	150.4	32.6	-17.7	0	0	0	111.9
534	E	23.4	Very low	32	Very low	145 Å²	145	117.8 Å²	117.8	68%	0.678	77%	0.773	S	S	*	*			trans	-168.9	177.9	179.1	-119.6	-165.3	115.1	0	0	109.4	K532	K532-E534 WeakPolarHBondContact CE-OE2 3.49Å; K532-E534 IonicContact NZ-OE2 2.66Å; K532-E534 PolarHBondContact NZ-OE2 3.14Å
535	P	48.3	Very low	33	Very low	105 Å²	105	116.9 Å²	116.9	68%	0.682	76%	0.764	S	S	*	*			cis	-134.5	179.2	-14.4	40.1	-24.2	0	0	0	114.7
536	A	27	Very low	32.7	Very low	94 Å²	94	118.1 Å²	118.1	78%	0.777	77%	0.768	S	S	*	*			trans	176.4	106.9	133.6	0	0	0	0	0	116.7
537	A	35.9	Very low	32.9	Very low	100 Å²	100	120 Å²	120	83%	0.826	77%	0.773	S	S	*	*			trans	61.5	152.1	136.8	0	0	0	0	0	125.1
538	P	41.4	Very low	32.9	Very low	113 Å²	113	123.3 Å²	123.3	73%	0.734	78%	0.777	S	S	*	*			trans	-149.6	173.4	-154	46.2	-25	0	0	0	120.4
539	V	30.9	Very low	32.9	Very low	139 Å²	139	124.8 Å²	124.8	84%	0.842	78%	0.776	S	S	*	*			trans	51.9	176.4	159.7	-87.5	0	0	0	0	119.7
540	P	42.2	Very low	33.1	Very low	127 Å²	127	125.1 Å²	125.1	83%	0.825	76%	0.764	S	S	*	*			cis	-123.4	-162.8	-1.6	42.3	-25.2	0	0	0	115.3
541	A	29.9	Very low	33.2	Very low	94 Å²	94	128 Å²	128	78%	0.777	77%	0.772	S	S	*	*			trans	-143.5	161.1	-177.6	0	0	0	0	0	113.6
542	A	34.8	Very low	33.5	Very low	99 Å²	99	126.8 Å²	126.8	82%	0.818	77%	0.77	S	S	*	*			trans	67.8	151	174.4	0	0	0	0	0	115.1
543	P	34.7	Very low	33.9	Very low	131 Å²	131	121.4 Å²	121.4	85%	0.851	76%	0.759	S	S	*	*			cis	-136.6	-159.9	44.2	43.6	-25.1	0	0	0	115.5
544	A	26.3	Very low	33.4	Very low	89 Å²	89	123.5 Å²	123.5	74%	0.736	76%	0.762	S	S	*	*			trans	-132.5	-170	168.9	0	0	0	0	0	108.3
545	P	47.3	Very low	33.9	Very low	108 Å²	108	122.3 Å²	122.3	70%	0.701	77%	0.77	S	S	*	*			cis	-129.8	-167.8	-21.5	39.6	-21.7	0	0	0	113.1
546	T	26.3	Very low	32.9	Very low	122 Å²	122	121.1 Å²	121.1	75%	0.748	78%	0.777	S	S	*	*			trans	57.5	118.4	156.5	50.9	0	0	0	0	122.2
547	E	29.6	Very low	32.9	Very low	203 Å²	203	125.7 Å²	125.7	95%	0.949	78%	0.783	S	S	*	*			trans	-137.5	143.3	135.4	-80.1	-164.1	139.5	0	0	109.7
548	E	30.8	Very low	32.5	Very low	175 Å²	175	127.7 Å²	127.7	82%	0.818	78%	0.78	S	S	*	*			trans	-139.8	168.1	173.2	-59.3	-177.4	162.5	0	0	106.6
549	V	32.9	Very low	31.9	Very low	128 Å²	128	129.2 Å²	129.2	78%	0.776	78%	0.78	S	S	*	*			cis	-148.3	-171.1	11.5	-130.7	0	0	0	0	106.5
550	D	32.8	Very low	31.6	Very low	100 Å²	100	130.2 Å²	130.2	54%	0.535	78%	0.78	S	S	.	*			cis	-141.8	-123.9	4.3	179.2	65.1	0	0	0	108.3	G553	D550-G553 PolarHBondContact OD1-N 3.41Å; D550-G553 PolarHBondContact OD2-N 2.71Å
551	L	34.7	Very low	30.9	Very low	154 Å²	154	133.9 Å²	133.9	81%	0.806	78%	0.778	S	S	*	*	S	Bend	trans	51.7	78.6	-173.9	-59.3	-177.6	0	0	0	113.1
552	L	33	Very low	31.1	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	78%	0.778	S	S	*	*	S	Bend	cis	-143.4	112.9	20.7	-67.3	162.4	0	0	0	112.4
553	G	29.8	Very low	30.6	Very low	42 Å²	42	134.5 Å²	134.5	43%	0.433	77%	0.767	S	S	.	*			trans	-66.8	178.8	154.4	0	0	0	0	0	112.5	D550	D550-G553 PolarHBondContact OD1-N 3.41Å; D550-G553 PolarHBondContact OD2-N 2.71Å
554	L	28.7	Very low	30.9	Very low	165 Å²	165	133.6 Å²	133.6	86%	0.864	76%	0.761	S	S	*	*			cis	-148.1	157.5	21.8	-76.9	165.6	0	0	0	112.3
555	S	34.3	Very low	31.1	Very low	120 Å²	120	134.5 Å²	134.5	84%	0.839	76%	0.762	S	S	*	*			trans	-74.9	146.2	157.3	51.1	0	0	0	0	111.4
556	G	28.1	Very low	30.3	Very low	81 Å²	81	134.6 Å²	134.6	84%	0.835	77%	0.765	S	S	*	*			trans	-161.7	138.2	171.8	0	0	0	0	0	110.9
557	E	27.2	Very low	30.3	Very low	190 Å²	190	137.2 Å²	137.2	89%	0.888	77%	0.769	S	S	*	*			trans	-109	154.7	-170.5	-140.1	158.8	116	0	0	111.9
558	D	26.5	Very low	31.1	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	76%	0.762	S	S	*	*			trans	78.7	153.7	156.6	-128.8	-22.6	0	0	0	122.2
559	I	28.6	Very low	30.8	Very low	145 Å²	145	128.9 Å²	128.9	74%	0.744	75%	0.754	S	S	*	*			trans	60.3	101	167.7	-51.7	161	0	0	0	115.9
560	N	24.9	Very low	30.5	Very low	159 Å²	159	127.5 Å²	127.5	85%	0.85	76%	0.756	S	S	*	*				-165.6	170	74.3	-154	-15.5	0	0	0	113.6
561	R	27.9	Very low	30.1	Very low	204 Å²	204	127.4 Å²	127.4	77%	0.77	77%	0.77	S	S	*	*			trans	-82	172.1	-178.3	-108.6	-170.9	174.6	-162.8	0.1	113.3
562	P	34.9	Very low	29.8	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	77%	0.769	S	S	*	*			cis	-142.6	178.4	35.3	41.5	-20.7	0	0	0	120
563	C	23.1	Very low	29.6	Very low	87 Å²	87	121.1 Å²	121.1	59%	0.588	76%	0.763	S	S	*	*			trans	-41.8	174.5	161.6	-81.2	0	0	0	0	117.2
564	P	41.3	Very low	29.6	Very low	111 Å²	111	125.4 Å²	125.4	72%	0.721	78%	0.781	S	S	*	*			cis	-132.6	153.7	11.1	15.8	10.5	0	0	0	119
565	S	31.3	Very low	29.6	Very low	109 Å²	109	124.5 Å²	124.5	76%	0.762	78%	0.777	S	S	*	*				25.5	159	127.4	81.5	0	0	0	0	122.4
566	S	29.9	Very low	29.8	Very low	110 Å²	110	125.7 Å²	125.7	77%	0.769	77%	0.773	S	S	*	*			cis	-155.1	147.9	24.2	42.6	0	0	0	0	115.9
567	Q	26.9	Very low	30.1	Very low	176 Å²	176	130 Å²	130	82%	0.822	78%	0.776	S	S	*	*			trans	-64.8	176.1	158.2	-96.7	177	-7.3	0	0	112.1
568	P	44.8	Very low	30.2	Very low	125 Å²	125	124.3 Å²	124.3	81%	0.812	77%	0.768	S	S	*	*			cis	-143.8	-164	35	35.9	-11.6	0	0	0	115.7
569	A	26.2	Very low	30.4	Very low	79 Å²	79	124.5 Å²	124.5	65%	0.653	77%	0.769	S	S	*	*				-170.3	163.3	-50.6	0	0	0	0	0	110.5
570	A	25	Very low	30.7	Very low	98 Å²	98	123.8 Å²	123.8	81%	0.81	77%	0.766	S	S	*	*			trans	61.4	141.6	148.2	0	0	0	0	0	123.8
571	A	25.5	Very low	31.1	Very low	99 Å²	99	126 Å²	126	82%	0.818	77%	0.769	S	S	*	*			trans	83.8	152.8	146.8	0	0	0	0	0	121.2
572	A	27.2	Very low	30.9	Very low	97 Å²	97	120.1 Å²	120.1	80%	0.802	77%	0.771	S	S	*	*			trans	58.6	116.8	-177.2	0	0	0	0	0	115.5
573	A	28.9	Very low	30.5	Very low	85 Å²	85	119 Å²	119	70%	0.702	77%	0.773	S	S	*	*			cis	79.5	135.1	45.2	0	0	0	0	0	114.1
574	T	29.9	Very low	32.5	Very low	132 Å²	132	120.7 Å²	120.7	81%	0.81	78%	0.782	S	S	*	*			trans	62.1	159.3	175.3	37.9	0	0	0	0	115.3
575	D	30.1	Very low	33	Very low	145 Å²	145	121.6 Å²	121.6	78%	0.775	79%	0.788	S	S	*	*			cis	-143.1	-177.8	5.2	-138.7	-33.1	0	0	0	113.5
576	L	36.6	Very low	33.2	Very low	145 Å²	145	125.1 Å²	125.1	76%	0.759	79%	0.792	S	S	*	*			trans	-95.4	163.9	179.5	-97.3	165.8	0	0	0	113.8
577	L	36.2	Very low	34.6	Very low	172 Å²	172	125.2 Å²	125.2	90%	0.901	79%	0.79	S	S	*	*			trans	77.8	163.9	161.7	-63.9	157	0	0	0	119
578	G	28.3	Very low	34.9	Very low	70 Å²	70	121.2 Å²	121.2	72%	0.722	79%	0.787	S	S	*	*			trans	107.2	91.6	-163.6	0	0	0	0	0	110.3
579	D	30.4	Very low	34.5	Very low	147 Å²	147	120.7 Å²	120.7	79%	0.786	79%	0.787	S	S	*	*			cis	79.5	123	22.2	-151.8	33.8	0	0	0	116.7
580	L	35.9	Very low	34.9	Very low	130 Å²	130	121.4 Å²	121.4	68%	0.681	79%	0.792	S	S	*	*	S	Bend	trans	38	105.2	153.8	-144.5	71.6	0	0	0	122.9
581	F	32.8	Very low	36.5	Very low	206 Å²	206	122.8 Å²	122.8	90%	0.904	79%	0.793	S	S	*	*			trans	64.8	150.3	147	-78.4	-124.3	0	0	0	119.7
582	G	23.9	Very low	36.9	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	79%	0.789	S	S	*	*			trans	170.2	142.6	168.4	0	0	0	0	0	114.1
583	A	26.8	Very low	37.5	Very low	97 Å²	97	123.4 Å²	123.4	80%	0.802	79%	0.786	S	S	*	*			trans	-130.3	165.2	179.6	0	0	0	0	0	110.6
584	P	64.1	Low	37.8	Very low	121 Å²	121	124.6 Å²	124.6	79%	0.786	79%	0.785	S	S	*	*			trans	-88.1	-179.1	-164.8	37.9	-38.2	0	0	0	113.8
585	P	51.9	Low	38	Very low	130 Å²	130	126 Å²	126	84%	0.844	78%	0.782	S	S	*	*				-144.9	-176.6	103.5	38.6	-22.6	0	0	0	117.1
586	Q	36.6	Very low	38.3	Very low	184 Å²	184	123.3 Å²	123.3	86%	0.86	77%	0.774	S	S	*	*			trans	-79.4	-165.5	-178.1	-114.7	-171.7	-4.6	0	0	113.4
587	P	58.3	Low	38.2	Very low	111 Å²	111	122.3 Å²	122.3	72%	0.721	77%	0.774	S	S	*	*			cis	-142.6	-167.1	14.2	39.8	-17	0	0	0	118.2
588	A	33.9	Very low	39.2	Very low	92 Å²	92	118.9 Å²	118.9	76%	0.76	76%	0.763	S	S	*	*			trans	90.9	145.5	153	0	0	0	0	0	120.2
589	S	36.5	Very low	39.3	Very low	115 Å²	115	124.5 Å²	124.5	80%	0.804	77%	0.769	S	S	*	*			cis	-168.3	172.1	-19.5	56.8	0	0	0	0	113.3
590	A	33.6	Very low	39.3	Very low	93 Å²	93	126.7 Å²	126.7	77%	0.769	77%	0.772	S	S	*	*			trans	96.8	141.6	162.8	0	0	0	0	0	118.7
591	P	58.8	Low	39.1	Very low	127 Å²	127	126.7 Å²	126.7	83%	0.825	78%	0.777	S	S	*	*			trans	-92.6	-172.1	-165.4	43.4	-40.5	0	0	0	111.9
592	S	35.2	Very low	39	Very low	106 Å²	106	121 Å²	121	74%	0.741	77%	0.768	S	S	*	*			cis	-161.2	-172.6	23.8	75.7	0	0	0	0	110.1
593	S	38.7	Very low	40.3	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	77%	0.769	S	S	*	*			cis	-164	-176.1	3.4	48.5	0	0	0	0	107.6
594	T	35.5	Very low	40.5	Very low	110 Å²	110	126 Å²	126	68%	0.675	77%	0.769	S	S	*	*			cis	-132.4	-45.4	0.2	53	0	0	0	0	113.8
595	Q	34.1	Very low	39	Very low	162 Å²	162	125.3 Å²	125.3	76%	0.757	77%	0.768	S	S	*	*			trans	-155.5	163.9	-150.5	-77.7	156.8	-85.4	0	0	109.9
596	S	35.8	Very low	38	Very low	88 Å²	88	123.9 Å²	123.9	62%	0.615	77%	0.767	S	S	*	*			cis	-161.5	151.7	-12.9	-108.6	0	0	0	0	107.8
597	T	34.5	Very low	37.8	Very low	123 Å²	123	120.8 Å²	120.8	76%	0.755	77%	0.765	S	S	*	*			cis	74.3	148.8	20.3	80.1	0	0	0	0	115.9
598	P	57.9	Low	37.6	Very low	101 Å²	101	120.8 Å²	120.8	66%	0.656	77%	0.766	S	S	*	*			cis	-117.6	179.6	-2.9	41.3	-26.3	0	0	0	112.4
599	H	30.1	Very low	37.2	Very low	187 Å²	187	121.6 Å²	121.6	87%	0.866	77%	0.765	S	S	*	*			cis	-130.6	-180	14.1	-90.6	-79.5	0	0	0	113.4
600	K	31.2	Very low	37.8	Very low	193 Å²	193	121.1 Å²	121.1	84%	0.839	76%	0.76	S	S	*	*			trans	-158.8	166	-167.9	178.2	-177.2	178.8	-178.5	0	108.5
601	V	31.3	Very low	37.5	Very low	130 Å²	130	122 Å²	122	79%	0.788	76%	0.761	S	S	*	*			trans	150.4	143.5	135.9	161	0	0	0	0	115.5
602	A	30.9	Very low	36.8	Very low	87 Å²	87	122.4 Å²	122.4	72%	0.719	76%	0.763	S	S	*	*			trans	72.8	162.6	157.1	0	0	0	0	0	119.6
603	P	50.6	Low	36.6	Very low	128 Å²	128	122.1 Å²	122.1	83%	0.831	77%	0.767	S	S	*	*			cis	-125.3	-170.2	5.6	43	-28.4	0	0	0	116.1
604	N	31.2	Very low	37.7	Very low	153 Å²	153	122.6 Å²	122.6	82%	0.818	77%	0.768	S	S	*	*			trans	-134.2	161.7	177.7	-154.2	17.6	0	0	0	110
605	S	32.4	Very low	38.4	Very low	107 Å²	107	123.4 Å²	123.4	75%	0.748	78%	0.775	S	S	*	*			trans	5.4	124.8	170.8	-54.8	0	0	0	0	122.2
606	A	30.2	Very low	38.3	Very low	100 Å²	100	119.6 Å²	119.6	83%	0.826	77%	0.771	S	S	*	*			trans	-169.2	167	145.6	0	0	0	0	0	114.1
607	S	32.2	Very low	38	Very low	119 Å²	119	125.6 Å²	125.6	83%	0.832	79%	0.787	S	S	*	*			trans	-161.4	165.2	163.3	-73.5	0	0	0	0	107.6
608	P	54.3	Low	38.1	Very low	112 Å²	112	127.9 Å²	127.9	73%	0.727	79%	0.788	S	S	*	*			cis	-133.5	-173.2	3.8	42.6	-25.7	0	0	0	115.6
609	S	27.3	Very low	37.9	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	79%	0.785	S	S	*	*			trans	73.2	175.7	149.7	81	0	0	0	0	118.9
610	P	49.1	Very low	38.2	Very low	106 Å²	106	127.5 Å²	127.5	69%	0.688	78%	0.783	S	S	*	*				-138.6	-177.4	-90.3	41.7	-23.4	0	0	0	117.2
611	S	26.3	Very low	38.2	Very low	112 Å²	112	121.3 Å²	121.3	78%	0.783	78%	0.775	S	S	*	*			trans	107.4	131.2	155.9	-43.9	0	0	0	0	118
612	P	43.9	Very low	38.4	Very low	134 Å²	134	121.5 Å²	121.5	87%	0.87	78%	0.776	S	S	*	*			trans	-106.6	152.5	168.7	38.1	-30.8	0	0	0	113.8
613	A	32	Very low	38.6	Very low	101 Å²	101	121.1 Å²	121.1	84%	0.835	77%	0.773	S	S	*	*			trans	-150.9	160.7	172.7	0	0	0	0	0	112
614	P	60.8	Low	38.8	Very low	113 Å²	113	120.6 Å²	120.6	73%	0.734	77%	0.77	S	S	*	*			trans	-110.5	-176	-155.7	43.7	-36.4	0	0	0	115.2
615	P	50	Low	38.8	Very low	127 Å²	127	120.5 Å²	120.5	83%	0.825	77%	0.767	S	S	*	*				-128.6	149.7	91.3	14.8	5.7	0	0	0	112.5
616	A	32.5	Very low	40.1	Very low	83 Å²	83	121.4 Å²	121.4	69%	0.686	77%	0.771	S	S	*	*			cis	97.3	114	31	0	0	0	0	0	114.4
617	F	29.2	Very low	40.1	Very low	214 Å²	214	124.6 Å²	124.6	94%	0.939	77%	0.766	S	S	*	*			trans	-160.5	130.6	155.8	-116.4	-75.7	0	0	0	109.9
618	H	35.8	Very low	40.9	Very low	170 Å²	170	124.8 Å²	124.8	79%	0.787	77%	0.765	S	S	*	*			trans	-166.1	154.2	-179.1	-132.7	-58.6	0	0	0	111.7
619	P	55.4	Low	39.6	Very low	89 Å²	89	126.9 Å²	126.9	58%	0.578	77%	0.765	S	S	*	*			trans	-132.9	163.2	136.2	38.6	-29.1	0	0	0	110.7
620	F	34.6	Very low	39.7	Very low	191 Å²	191	131.2 Å²	131.2	84%	0.838	77%	0.773	S	S	*	*			cis	-111.7	-164.6	-12.9	-67.7	-80.1	0	0	0	107.8
621	G	31.4	Very low	38.6	Very low	64 Å²	64	133.6 Å²	133.6	66%	0.66	78%	0.777	S	S	*	*			cis	82.9	141.5	14.4	0	0	0	0	0	112.8
622	T	35.4	Very low	38.6	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	78%	0.781	S	S	*	*			cis	-151.4	127.7	-4.7	41	0	0	0	0	107.3
623	A	35.1	Very low	37.7	Very low	80 Å²	80	133.6 Å²	133.6	66%	0.661	77%	0.774	S	S	*	*				76.4	163.5	90.1	0	0	0	0	0	113.9
624	P	54.7	Low	37.5	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	77%	0.774	S	S	*	*			cis	-111.3	169.7	-0.6	15.9	9.5	0	0	0	113.4
625	I	32.8	Very low	35.8	Very low	150 Å²	150	138.4 Å²	138.4	77%	0.769	78%	0.78	S	S	*	*			cis	80.2	138.2	37.3	-63	170.1	0	0	0	112
626	P	59.5	Low	35.1	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	78%	0.782	S	S	*	*			cis	-136.3	-172.3	22.2	29.6	-3.6	0	0	0	119.8
627	K	30	Very low	34.9	Very low	167 Å²	167	139.7 Å²	139.7	73%	0.726	79%	0.785	S	S	*	*			trans	-71.4	-175.9	173.3	-101.7	-176.2	-177.5	-163.5	0	114.7
628	P	47.7	Very low	35.6	Very low	124 Å²	124	135.9 Å²	135.9	81%	0.805	78%	0.781	S	S	*	*			cis	-149	-165	37.9	45.3	-22.5	0	0	0	119.7
629	Q	28.6	Very low	35.2	Very low	156 Å²	156	131.5 Å²	131.5	73%	0.729	78%	0.782	S	S	*	*			trans	-98.5	166.5	-177.2	-59.6	144.7	-126.5	0	0	112.3
630	E	27.8	Very low	34	Very low	198 Å²	198	134.7 Å²	134.7	93%	0.925	79%	0.794	S	S	*	*			trans	-145.2	-176	151.5	-155.4	149.4	-115.1	0	0	110.1
631	M	26.9	Very low	33.9	Very low	157 Å²	157	132.2 Å²	132.2	77%	0.773	79%	0.794	S	S	*	*			trans	-154.4	164.8	-167.3	-160.5	168.9	85.3	0	0	114.6
632	M	26.9	Very low	33.8	Very low	174 Å²	174	132.1 Å²	132.1	86%	0.857	79%	0.794	S	S	*	*			trans	74	161.2	-179.9	-48.5	-172	-173.7	0	0	114.5
633	G	24.5	Very low	33.6	Very low	72 Å²	72	134.5 Å²	134.5	74%	0.742	80%	0.796	S	S	*	*			cis	144.4	97.6	-13.2	0	0	0	0	0	114.9
634	S	27.8	Very low	33.9	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	80%	0.795	S	S	*	*			trans	-154.4	139.7	164.8	-74.5	0	0	0	0	108.3
635	F	25.3	Very low	32.8	Very low	195 Å²	195	137 Å²	137	86%	0.855	80%	0.797	S	S	*	*			cis	86.7	134.4	42.4	-104.7	-88.6	0	0	0	116.3
636	L	35.4	Very low	34	Very low	167 Å²	167	134.9 Å²	134.9	87%	0.874	79%	0.793	S	S	*	*			trans	80.1	133.2	178.7	-52.6	-180	0	0	0	118.1
637	G	27.8	Very low	32.4	Very low	71 Å²	71	138 Å²	138	73%	0.732	79%	0.794	S	S	*	*			trans	-109.3	-161.5	170.6	0	0	0	0	0	112
638	P	43.7	Very low	32.4	Very low	134 Å²	134	135 Å²	135	87%	0.87	79%	0.79	S	S	*	*				-146	160.7	65.8	39.8	-23.3	0	0	0	117.9
639	G	28.3	Very low	31.5	Very low	78 Å²	78	137.5 Å²	137.5	80%	0.804	79%	0.79	S	S	*	*			trans	87.3	133.4	154	0	0	0	0	0	117
640	N	29.7	Very low	31.3	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	79%	0.789	S	S	*	*			cis	-153.4	140.3	-1	-156.7	26.5	0	0	0	110.3
641	V	32.4	Very low	31.1	Very low	139 Å²	139	128.8 Å²	128.8	84%	0.842	78%	0.779	S	S	*	*			trans	12.9	128	170.4	-161.1	0	0	0	0	119.8
642	G	29.2	Very low	31	Very low	63 Å²	63	132.8 Å²	132.8	65%	0.649	79%	0.785	S	S	*	*			cis	163.6	119.4	-7.6	0	0	0	0	0	115.6
643	Q	30.9	Very low	31.4	Very low	183 Å²	183	129.8 Å²	129.8	86%	0.855	78%	0.781	S	S	*	*			trans	48.8	149.3	145.6	-65.7	-81.1	-79.6	0	0	122.7
644	P	42.4	Very low	32.2	Very low	101 Å²	101	132.2 Å²	132.2	66%	0.656	78%	0.784	S	S	*	*			cis	-141.9	170.7	-33	39.5	-21.5	0	0	0	117
645	D	30.7	Very low	32.4	Very low	148 Å²	148	131.5 Å²	131.5	79%	0.791	78%	0.779	S	S	*	*			trans	-56.3	-176.3	159.3	-72.1	-78.7	0	0	0	116.3
646	P	58.6	Low	33.5	Very low	106 Å²	106	127.5 Å²	127.5	69%	0.688	77%	0.772	S	S	*	*			cis	-135.5	-158.1	-15.2	21.4	5.6	0	0	0	113.7
647	F	25.3	Very low	33.2	Very low	190 Å²	190	125 Å²	125	83%	0.833	76%	0.764	S	S	*	*			trans	112.7	164	151.3	-102.2	-120.3	0	0	0	119.6
648	V	31.1	Very low	33.3	Very low	106 Å²	106	129.5 Å²	129.5	64%	0.642	77%	0.771	S	S	*	*			trans	-76.3	169.5	-156.5	-74.5	0	0	0	0	117.4
649	H	27.4	Very low	32.7	Very low	175 Å²	175	131.4 Å²	131.4	81%	0.81	77%	0.768	S	S	*	*			trans	78.3	121.8	147.7	-82.8	-59.6	0	0	0	120.5
650	A	24.6	Very low	33.8	Very low	86 Å²	86	132.4 Å²	132.4	71%	0.711	76%	0.76	S	S	*	*				73.1	141.9	123.5	0	0	0	0	0	122.1
651	A	24.4	Very low	33.7	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	76%	0.759	S	S	*	*			trans	66.7	118.4	138	0	0	0	0	0	121.2
652	R	24.3	Very low	33.6	Very low	242 Å²	242	129.2 Å²	129.2	91%	0.913	75%	0.751	S	S	*	*			trans	75	135.4	137	-68.1	177.4	168.7	-178.7	-4.8	119.7
653	S	35.1	Very low	33.6	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	76%	0.764	S	S	*	*			trans	-44.8	160.5	149.2	-2	0	0	0	0	112.8
654	P	42.1	Very low	33.4	Very low	124 Å²	124	130.2 Å²	130.2	81%	0.805	76%	0.759	S	S	*	*			cis	-147	-177.2	48.1	39.9	-18.9	0	0	0	117.8
655	S	32.4	Very low	33.5	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	76%	0.763	S	S	*	*			trans	-63.1	-171.9	157.9	-34.6	0	0	0	0	111.7
656	P	48.7	Very low	33.4	Very low	111 Å²	111	129.4 Å²	129.4	72%	0.721	76%	0.76	S	S	*	*			cis	-147.8	-168.7	12.6	32.8	-6	0	0	0	118
657	T	28.9	Very low	31.9	Very low	115 Å²	115	130.2 Å²	130.2	71%	0.706	76%	0.762	S	S	*	*			trans	77.8	120.7	148.2	6.7	0	0	0	0	121.4
658	L	28.3	Very low	31.9	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	76%	0.756	S	S	*	*				-169.7	173.4	97.3	-99.6	168.3	0	0	0	112.7
659	Q	32.4	Very low	31.8	Very low	174 Å²	174	128.9 Å²	128.9	81%	0.813	76%	0.759	S	S	*	*			trans	-113.1	-147.3	-169	-38.7	174.1	-48.8	0	0	110.7
660	P	50.8	Low	31.7	Very low	99 Å²	99	127.2 Å²	127.2	64%	0.643	75%	0.752	S	S	*	*			cis	-142	-174.7	7.4	45.4	-25.2	0	0	0	118.2
661	T	27.4	Very low	31.8	Very low	130 Å²	130	129.2 Å²	129.2	80%	0.798	75%	0.746	S	S	*	*			trans	68.1	150	160.2	55.1	0	0	0	0	120.7
662	S	29.7	Very low	31.9	Very low	97 Å²	97	132.4 Å²	132.4	68%	0.678	75%	0.747	S	S	*	*			cis	-172.4	169.9	-29.6	54.1	0	0	0	0	111.1
663	L	29.6	Very low	32	Very low	176 Å²	176	128.1 Å²	128.1	92%	0.921	74%	0.742	S	S	*	*			trans	91.7	158	169.2	-55.5	170.3	0	0	0	119.2
664	A	26.9	Very low	31.6	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	74%	0.743	S	S	*	*			trans	-141.3	-164.2	-171.2	0	0	0	0	0	108.5
665	P	45.5	Very low	30.6	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	75%	0.747	S	S	*	*			cis	-146.1	-173.4	5.1	33.1	-7	0	0	0	118.5
666	T	27	Very low	30.3	Very low	119 Å²	119	129.2 Å²	129.2	73%	0.73	75%	0.753	S	S	*	*			trans	99.9	140	140.3	-3.3	0	0	0	0	124.4
667	V	29.1	Very low	29	Very low	123 Å²	123	126.8 Å²	126.8	75%	0.745	75%	0.749	S	S	*	*			trans	68.5	128.1	153.4	-86.7	0	0	0	0	126.9
668	N	24.1	Very low	28.9	Very low	129 Å²	129	132.9 Å²	132.9	69%	0.69	76%	0.759	S	S	*	*			trans	79.8	105.9	133.1	-82	16.7	0	0	0	126.2
669	I	29	Very low	28.7	Very low	139 Å²	139	130.5 Å²	130.5	71%	0.713	75%	0.747	S	S	*	*				74.2	139.4	101.1	-87.3	175	0	0	0	122.6
670	Q	25.1	Very low	28.4	Very low	141 Å²	141	132.2 Å²	132.2	66%	0.659	75%	0.746	S	S	*	*			trans	104	111.6	150.2	-136.9	63.3	-3.7	0	0	122.8
671	Q	28	Very low	27.1	Very low	128 Å²	128	133.1 Å²	133.1	60%	0.598	75%	0.746	S	S	*	*			trans	61.4	126.2	137.7	-71.9	179.6	-64	0	0	127.1
672	Q	26.3	Very low	26.9	Very low	152 Å²	152	137.7 Å²	137.7	71%	0.71	75%	0.749	S	S	*	*				73.9	117.1	121.8	-69.2	172.5	-23.4	0	0	124.9
673	N	25.4	Very low	27.3	Very low	151 Å²	151	138.3 Å²	138.3	81%	0.807	75%	0.75	S	S	*	*				30.7	117.4	117.6	-71.9	3.9	0	0	0	121.6
674	A	25.9	Very low	27.1	Very low	96 Å²	96	133.7 Å²	133.7	79%	0.793	74%	0.737	S	S	*	*				-155	136.9	114	0	0	0	0	0	107.4
675	M	22.6	Very low	26.9	Very low	181 Å²	181	135.5 Å²	135.5	89%	0.892	74%	0.74	S	S	*	*			cis	65.9	103.3	37.1	-71.3	-67.7	-77.4	0	0	114.6
676	G	25.4	Very low	26.1	Very low	83 Å²	83	135.9 Å²	135.9	86%	0.856	74%	0.74	S	S	*	*			trans	166.5	134	174.8	0	0	0	0	0	110.5
677	G	22.1	Very low	26.1	Very low	61 Å²	61	134.6 Å²	134.6	63%	0.629	74%	0.736	S	S	*	*			trans	-115	-178.6	179.3	0	0	0	0	0	113
678	W	26	Very low	26.1	Very low	242 Å²	242	135.6 Å²	135.6	92%	0.917	74%	0.742	S	S	*	*			trans	55.5	136.8	133.4	-52.1	-16.5	0	0	0	118.7
679	D	25.3	Very low	26.4	Very low	115 Å²	115	133.1 Å²	133.1	62%	0.615	75%	0.747	S	S	*	*			cis	-165.5	167.1	5.4	-111.7	-18	0	0	0	113.4
680	W	25.8	Very low	26.4	Very low	210 Å²	210	130.7 Å²	130.7	80%	0.795	76%	0.756	S	S	*	*			trans	73.7	127.4	147.9	-101.1	-133	0	0	0	124.7
681	N	24	Very low	26.6	Very low	118 Å²	118	126.7 Å²	126.7	63%	0.631	75%	0.753	S	S	*	*			trans	62.2	106.1	138.5	-95	-19	0	0	0	123.8
682	R	22.9	Very low	26.6	Very low	226 Å²	226	131.1 Å²	131.1	85%	0.853	77%	0.771	S	S	*	*				60.2	167.1	117.2	-93.1	-171.3	-143.7	-100.8	-1.2	121.2
683	P	38.1	Very low	26.7	Very low	110 Å²	110	127.1 Å²	127.1	71%	0.714	77%	0.771	S	S	*	*			cis	-133.7	-177.8	-8.5	39	-21.4	0	0	0	116.3
684	A	24.4	Very low	27.1	Very low	79 Å²	79	128.4 Å²	128.4	65%	0.653	78%	0.776	S	S	*	*			trans	88.1	133.9	139.5	0	0	0	0	0	122.4
685	T	23.8	Very low	27.2	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	77%	0.769	S	S	*	*			trans	66.9	146.4	151.6	47.1	0	0	0	0	118.5
686	T	27.4	Very low	27.6	Very low	121 Å²	121	123.5 Å²	123.5	74%	0.742	76%	0.764	S	S	*	*			cis	-151.2	149.2	10.5	-16.2	0	0	0	0	114.1
687	S	28.3	Very low	28	Very low	91 Å²	91	130.7 Å²	130.7	64%	0.636	77%	0.765	S	S	*	*			trans	52.5	122.9	138.3	66.2	0	0	0	0	124.4
688	T	29	Very low	28.6	Very low	144 Å²	144	133.2 Å²	133.2	88%	0.883	77%	0.773	S	S	*	*			trans	47	143.4	130.1	61.2	0	0	0	0	122.7
689	G	29.3	Very low	28.8	Very low	77 Å²	77	125.6 Å²	125.6	79%	0.794	76%	0.761	S	S	*	*			cis	152.3	170	-3.2	0	0	0	0	0	114.5
690	G	29.1	Very low	28.8	Very low	88 Å²	88	126.9 Å²	126.9	91%	0.907	77%	0.774	S	S	*	*			trans	97	145.3	174	0	0	0	0	0	115.3
691	G	29.2	Very low	29.1	Very low	58 Å²	58	123.3 Å²	123.3	60%	0.598	78%	0.775	S	S	*	*			cis	170.8	151.3	-10.1	0	0	0	0	0	114.3
692	F	28.7	Very low	29.4	Very low	220 Å²	220	123 Å²	123	97%	0.965	78%	0.782	S	S	*	*			trans	65.6	153.5	172.5	-43.7	-79.7	0	0	0	115.5
693	G	27.4	Very low	30.6	Very low	69 Å²	69	118.1 Å²	118.1	71%	0.711	78%	0.78	S	S	*	*			cis	162.6	164	-1.8	0	0	0	0	0	108.5
694	I	34.3	Very low	30.4	Very low	177 Å²	177	120 Å²	120	91%	0.908	79%	0.79	S	S	*	*			cis	-162	153.6	-7.4	-87.6	167.9	0	0	0	104.2
695	G	27.6	Very low	30.7	Very low	64 Å²	64	120.1 Å²	120.1	66%	0.66	80%	0.798	S	S	*	*			cis	177.6	-159.5	6.1	0	0	0	0	0	112.6
696	S	30.8	Very low	31.3	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	80%	0.798	S	S	*	*			trans	45.6	109.7	170.3	-59.8	0	0	0	0	120.2
697	R	34.4	Very low	32	Very low	235 Å²	235	120.3 Å²	120.3	89%	0.887	80%	0.803	S	S	*	*			cis	79.9	138.4	47.3	-60.8	175.5	-175.9	-158.5	0.1	113.3
698	S	35.6	Very low	32.3	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	81%	0.813	S	S	*	*			cis	-161.4	173.2	20	-101.6	0	0	0	0	110.5
699	A	29.8	Very low	32.4	Very low	81 Å²	81	122.8 Å²	122.8	67%	0.669	81%	0.807	S	S	*	*			cis	-174.6	156.4	-20	0	0	0	0	0	111.8
700	T	25.4	Very low	32.3	Very low	143 Å²	143	124.9 Å²	124.9	88%	0.877	80%	0.804	S	S	*	*			trans	-153.9	130.2	154.5	25.7	0	0	0	0	108.9
701	T	31.7	Very low	33.4	Very low	135 Å²	135	125.9 Å²	125.9	83%	0.828	80%	0.795	S	S	*	*			trans	-152.9	140.8	-177.2	52.6	0	0	0	0	113.9
702	S	31.5	Very low	33.3	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	81%	0.808	S	S	*	*			trans	-70	-179.1	158.3	-46	0	0	0	0	111.6
703	P	46.7	Very low	33.2	Very low	125 Å²	125	126.6 Å²	126.6	81%	0.812	80%	0.795	S	S	*	*				-145.4	167	120.7	38.4	-25.3	0	0	0	115.6
704	T	35.1	Very low	33.3	Very low	150 Å²	150	130.8 Å²	130.8	92%	0.92	80%	0.796	S	S	*	*			trans	-131.4	156.3	163.6	49.3	0	0	0	0	109.3
705	G	30	Very low	32.9	Very low	81 Å²	81	129 Å²	129	84%	0.835	79%	0.793	S	S	*	*			trans	148.8	147.1	172.6	0	0	0	0	0	114.6
706	S	36.8	Very low	32.9	Very low	114 Å²	114	135.5 Å²	135.5	80%	0.797	80%	0.804	S	S	*	*			trans	-162.9	136.1	176.9	178.3	0	0	0	0	111
707	V	41.3	Very low	33	Very low	140 Å²	140	135.6 Å²	135.6	85%	0.848	80%	0.802	S	S	*	*			trans	-178.5	-178.3	136.7	-88.4	0	0	0	0	109.2
708	H	35.1	Very low	32.9	Very low	179 Å²	179	132 Å²	132	83%	0.829	80%	0.8	S	S	*	*			trans	-98.1	178.7	-175.4	-70.2	1.1	0	0	0	111.9
709	S	30.1	Very low	32.7	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	80%	0.796	S	S	*	*			cis	-158	-175.3	24.9	-154.8	0	0	0	0	115.7
710	T	27.9	Very low	32.9	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	81%	0.808	S	S	*	*			trans	-96.8	178.8	-178.4	49.8	0	0	0	0	113.5
711	P	51.5	Low	33.4	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	80%	0.795	S	S	*	*			cis	-137.2	167.7	-36.3	34.3	-17.8	0	0	0	114.3
712	T	26.8	Very low	33.9	Very low	143 Å²	143	133.9 Å²	133.9	88%	0.877	79%	0.789	S	S	*	*			trans	-166.4	158.7	141.4	4.9	0	0	0	0	115.3
713	H	28.5	Very low	34	Very low	150 Å²	150	137.4 Å²	137.4	69%	0.694	79%	0.791	S	S	*	*			trans	-8.8	129.6	177.2	-87.6	-105.9	0	0	0	124.3
714	Q	28	Very low	33.4	Very low	157 Å²	157	135.7 Å²	135.7	73%	0.734	79%	0.787	S	S	*	*				33.9	126.6	123.5	-61.4	174.5	-21.5	0	0	119.5
715	T	27.1	Very low	33.3	Very low	139 Å²	139	135.9 Å²	135.9	85%	0.853	78%	0.782	S	S	*	*				-166.1	159.3	86.5	20.6	0	0	0	0	113.2
716	K	27.8	Very low	33.8	Very low	201 Å²	201	139.8 Å²	139.8	87%	0.874	78%	0.782	S	S	*	*			trans	-109.9	140.2	160.3	-83.3	-173.3	173.3	-175	0	108.6
717	P	32.8	Very low	33.5	Very low	112 Å²	112	137.4 Å²	137.4	73%	0.727	78%	0.776	S	S	*	*				-126.5	179.6	106.9	1.5	21.1	0	0	0	111.2
718	N	30.5	Very low	33	Very low	159 Å²	159	138 Å²	138	85%	0.85	77%	0.774	S	S	*	*			cis	-145.9	158	-6.2	-128.8	1.9	0	0	0	109.1
719	T	31.6	Very low	33.1	Very low	118 Å²	118	136 Å²	136	72%	0.724	77%	0.769	S	S	*	*			trans	-100.6	144.4	170.2	-56.4	0	0	0	0	109.8	D721	T719-D721 HydrophobicContact CG2-CB 4.4Å
720	L	33.8	Very low	32.9	Very low	176 Å²	176	136.4 Å²	136.4	92%	0.921	77%	0.771	S	S	*	*			trans	-118.5	126.4	153.2	-85.3	171.7	0	0	0	108.2
721	D	35.8	Very low	33	Very low	111 Å²	111	134.2 Å²	134.2	59%	0.594	77%	0.765	S	S	*	*			trans	-118.7	123.5	-177.2	-176.6	-13.7	0	0	0	108	T719 F723	T719-D721 HydrophobicContact CG2-CB 4.4Å; D721-F723 PolarHBondContact OD1-N 2.91Å
722	P	42.8	Very low	32	Very low	108 Å²	108	135.1 Å²	135.1	70%	0.701	77%	0.774	S	S	*	*	S	Bend	trans	-87.6	-5.8	-179.5	34	-33.6	0	0	0	114.6
723	F	34.3	Very low	32.1	Very low	184 Å²	184	131.4 Å²	131.4	81%	0.807	76%	0.763	S	S	*	*			trans	-138.7	57.4	-175	-69.9	-68.7	0	0	0	113.9	D721 D725	D721-F723 PolarHBondContact OD1-N 2.91Å; F723-D725 PolarHBondContact O-N 3.17Å
724	A	33.8	Very low	32	Very low	89 Å²	89	134 Å²	134	74%	0.736	77%	0.773	S	S	*	*			trans	-72.5	113.5	155.6	0	0	0	0	0	110
725	D	33.9	Very low	32	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	77%	0.774	S	S	*	*				-163.5	163.6	124	-135.6	-35	0	0	0	112.5	F723	F723-D725 PolarHBondContact O-N 3.17Å
726	I	39.2	Very low	32.2	Very low	163 Å²	163	130.6 Å²	130.6	84%	0.836	77%	0.772	S	S	*	*			trans	63.2	114.7	178.6	-45.2	176.3	0	0	0	115.1
727	G	31	Very low	32.3	Very low	64 Å²	64	130.5 Å²	130.5	66%	0.66	77%	0.772	S	S	*	*			cis	141.9	110	-9.4	0	0	0	0	0	113.8
728	N	31.5	Very low	33.1	Very low	152 Å²	152	130.4 Å²	130.4	81%	0.813	77%	0.772	S	S	*	*			trans	67.6	136	160.7	-126.4	4.7	0	0	0	115.9
729	L	36.3	Very low	33	Very low	139 Å²	139	129.4 Å²	129.4	73%	0.728	77%	0.771	S	S	*	*			cis	-151.8	157.5	37.7	-83.8	156.9	0	0	0	112.4
730	C	26.5	Very low	33.2	Very low	116 Å²	116	130.1 Å²	130.1	78%	0.784	78%	0.775	S	S	*	*			trans	28.4	153.6	149.4	-65.5	0	0	0	0	123.7
731	A	29.8	Very low	33.6	Very low	74 Å²	74	127.2 Å²	127.2	61%	0.612	77%	0.767	S	S	*	*			cis	178.9	143.5	-23.8	0	0	0	0	0	108.6
732	S	30.6	Very low	33.3	Very low	129 Å²	129	128.7 Å²	128.7	90%	0.902	78%	0.78	S	S	*	*			trans	57.5	158.5	161.7	56.4	0	0	0	0	118.8
733	G	28.5	Very low	32.5	Very low	64 Å²	64	126.6 Å²	126.6	66%	0.66	78%	0.778	S	S	*	*			cis	175.7	137.4	-8.2	0	0	0	0	0	112.7
734	F	27.2	Very low	32.3	Very low	204 Å²	204	124.6 Å²	124.6	90%	0.895	78%	0.781	S	S	*	*			trans	18.9	117	159.8	-69.8	-85.4	0	0	0	122.8
735	S	28.1	Very low	32	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	79%	0.785	S	S	*	*				56.6	117.7	121.2	175.8	0	0	0	0	121.7
736	S	30	Very low	32.8	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	78%	0.775	S	S	*	*				-174.3	167.5	116.2	43.2	0	0	0	0	113.5
737	K	30.7	Very low	32.2	Very low	200 Å²	200	121.9 Å²	121.9	87%	0.87	78%	0.776	S	S	*	*			trans	-100.6	172.3	162.2	-60.1	-179.3	177.4	178.6	0	108
738	P	48.8	Very low	32.3	Very low	110 Å²	110	127.8 Å²	127.8	71%	0.714	78%	0.784	S	S	*	*			cis	-139.8	-150.8	10.4	32.7	-6.5	0	0	0	113.9
739	T	28.6	Very low	33.7	Very low	137 Å²	137	125.8 Å²	125.8	84%	0.84	78%	0.78	S	S	*	*			trans	90.3	129.7	160.7	66.6	0	0	0	0	121.4
740	T	35.3	Very low	34.5	Very low	133 Å²	133	124.7 Å²	124.7	82%	0.816	78%	0.781	S	S	*	*			trans	-96.2	157.2	152.2	16.4	0	0	0	0	108.2
741	P	43.3	Very low	34.9	Very low	115 Å²	115	128.4 Å²	128.4	75%	0.747	79%	0.789	S	S	*	*				-155.2	170.9	60.4	42	-20.4	0	0	0	119.8
742	T	29.4	Very low	34.8	Very low	142 Å²	142	128.4 Å²	128.4	87%	0.871	80%	0.796	S	S	*	*			trans	38.3	126.8	143.5	-48.4	0	0	0	0	124.3
743	G	26.1	Very low	34.9	Very low	64 Å²	64	128 Å²	128	66%	0.66	79%	0.793	S	S	*	*			trans	97.3	152.6	151.4	0	0	0	0	0	116.6
744	T	28.6	Very low	36	Very low	142 Å²	142	130.4 Å²	130.4	87%	0.871	80%	0.797	S	S	*	*			cis	-161.8	172.2	-9.4	-5.6	0	0	0	0	110.2
745	T	28.2	Very low	36.2	Very low	131 Å²	131	126.6 Å²	126.6	80%	0.804	80%	0.796	S	S	*	*			trans	-79.7	-165.7	-176.9	56.3	0	0	0	0	113.1
746	P	51.9	Low	36.3	Very low	96 Å²	96	131.5 Å²	131.5	62%	0.623	80%	0.798	S	S	*	*			cis	-143.7	-177.4	0.4	44.4	-25.6	0	0	0	118.1
747	S	25.6	Very low	36.5	Very low	123 Å²	123	131.6 Å²	131.6	86%	0.86	80%	0.796	S	S	*	*			trans	-163	159.4	141.8	-86.5	0	0	0	0	113.7
748	F	33	Very low	36.5	Very low	187 Å²	187	129.8 Å²	129.8	82%	0.82	79%	0.79	S	S	*	*			trans	-106.4	-178.7	-158.2	-75.1	-91	0	0	0	115.4
749	P	61.1	Low	36	Very low	111 Å²	111	130.3 Å²	130.3	72%	0.721	79%	0.794	S	S	*	*			cis	-112.7	-99.2	-13.4	21.8	2.9	0	0	0	111.8
750	P	52.6	Low	36.1	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	79%	0.788	S	S	*	*			cis	-99.9	-127.7	-8.5	41.5	-32.5	0	0	0	113.5
751	M	35.1	Very low	37.5	Very low	194 Å²	194	128.1 Å²	128.1	96%	0.956	79%	0.787	S	S	*	*			trans	-145.1	152	-172.5	-87.6	-175.4	-89.2	0	0	114.6
752	G	27.3	Very low	37.4	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	79%	0.789	S	S	*	*			trans	156.8	124.5	162.8	0	0	0	0	0	115.7
753	S	33.1	Very low	37.5	Very low	119 Å²	119	126.8 Å²	126.8	83%	0.832	78%	0.783	S	S	*	*			trans	-156.4	176.3	175.9	-51.1	0	0	0	0	108.9
754	P	52.1	Low	38	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	79%	0.794	S	S	*	*			cis	-138.8	-164.8	-0.7	42.5	-23.5	0	0	0	115.4
755	S	30.2	Very low	37.9	Very low	124 Å²	124	126 Å²	126	87%	0.867	79%	0.793	S	S	*	*			trans	94.9	165.8	148.1	81.4	0	0	0	0	121.8
756	R	30.9	Very low	37.9	Very low	211 Å²	211	123.8 Å²	123.8	80%	0.796	80%	0.795	S	S	*	*			trans	-149.8	136.1	-159.1	167.1	177.1	-161.4	-100.1	4.5	108.2
757	P	34.6	Very low	36.7	Very low	119 Å²	119	123.4 Å²	123.4	77%	0.773	81%	0.809	S	S	*	*				-157.9	-178.6	97.8	41.6	-20.6	0	0	0	118.2
758	Q	29.9	Very low	36.8	Very low	162 Å²	162	121.6 Å²	121.6	76%	0.757	81%	0.81	S	S	*	*			trans	-68.8	172.4	156.3	-73.7	177.1	-56.1	0	0	110.8
759	P	39.9	Very low	36.4	Very low	121 Å²	121	115.6 Å²	115.6	79%	0.786	80%	0.801	S	S	*	*			cis	-139.9	-159.6	21.5	38.7	-15	0	0	0	115.5
760	S	30	Very low	34.8	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	81%	0.808	S	S	*	*			trans	-72.6	172.7	160.5	50.4	0	0	0	0	111.4
761	P	64.3	Low	33.9	Very low	120 Å²	120	123.3 Å²	123.3	78%	0.779	81%	0.808	S	S	*	*			cis	-117	-143.9	2.4	43.4	-25.5	0	0	0	109.7
762	P	40.7	Very low	33.8	Very low	122 Å²	122	117.5 Å²	117.5	79%	0.792	79%	0.79	S	S	*	*			cis	-127.8	-97	-10.1	34.5	-11.1	0	0	0	115.4
763	S	31.6	Very low	33.9	Very low	106 Å²	106	123.4 Å²	123.4	74%	0.741	80%	0.798	S	S	*	*			trans	-155.4	156.2	-161.3	56.9	0	0	0	0	115.4
764	A	37.3	Very low	33.7	Very low	109 Å²	109	120.8 Å²	120.8	90%	0.901	79%	0.79	S	S	*	*			trans	73.4	117.2	154	0	0	0	0	0	121.6
765	G	27.3	Very low	32.6	Very low	82 Å²	82	125.2 Å²	125.2	85%	0.845	80%	0.8	S	S	*	*			trans	168.5	143.6	161	0	0	0	0	0	110.4
766	G	26.7	Very low	32.6	Very low	83 Å²	83	122.7 Å²	122.7	86%	0.856	79%	0.794	S	S	*	*			cis	164.3	95.1	-8.4	0	0	0	0	0	113.5
767	G	27.1	Very low	33.5	Very low	88 Å²	88	118.3 Å²	118.3	91%	0.907	79%	0.793	S	S	*	*			trans	97.1	144.1	174.3	0	0	0	0	0	114.8
768	G	27.6	Very low	33.3	Very low	85 Å²	85	119.4 Å²	119.4	88%	0.876	80%	0.798	S	S	*	*			cis	-172.7	168.8	-6.5	0	0	0	0	0	110.2
769	G	26	Very low	33.2	Very low	62 Å²	62	116.7 Å²	116.7	64%	0.639	80%	0.803	S	S	*	*			cis	176.1	-171.3	-2.4	0	0	0	0	0	110.8
770	W	27.4	Very low	32.9	Very low	229 Å²	229	119.9 Å²	119.9	87%	0.867	81%	0.807	S	S	*	*			trans	69.5	137.9	173.6	-51.7	81.4	0	0	0	116.9
771	Q	33.9	Very low	33.5	Very low	160 Å²	160	121 Å²	121	75%	0.748	81%	0.812	S	S	*	*			cis	-167.9	157	-23.9	-119.1	-171	3.9	0	0	106.5
772	A	33	Very low	32.2	Very low	71 Å²	71	124.4 Å²	124.4	59%	0.587	82%	0.815	S	S	*	*			cis	-156.2	163	-3.4	0	0	0	0	0	111.1
773	Q	29	Very low	32.2	Very low	198 Å²	198	124.3 Å²	124.3	93%	0.925	81%	0.814	S	S	*	*			trans	62.6	124.6	140.8	-164.4	169.5	-0.8	0	0	120.3
774	G	28.4	Very low	32.3	Very low	64 Å²	64	124.1 Å²	124.1	66%	0.66	81%	0.813	S	S	*	*			cis	153.9	144.1	-11.7	0	0	0	0	0	114.5
775	Q	28.9	Very low	32.8	Very low	209 Å²	209	124.6 Å²	124.6	98%	0.977	81%	0.807	S	S	*	*			trans	68.5	160.9	170.8	-51.1	174.9	10.2	0	0	115.4
776	G	30	Very low	33	Very low	72 Å²	72	125.1 Å²	125.1	74%	0.742	80%	0.797	S	S	*	*			cis	-162.8	-173.7	0.9	0	0	0	0	0	112.1
777	P	50.7	Low	33.4	Very low	118 Å²	118	129.3 Å²	129.3	77%	0.766	79%	0.794	S	S	*	*			trans	-116	170.1	-160.4	41.6	-34.4	0	0	0	118.2
778	T	29.5	Very low	33.5	Very low	142 Å²	142	131.5 Å²	131.5	87%	0.871	79%	0.79	S	S	*	*			trans	73.2	155.2	155.6	45.6	0	0	0	0	122.4
779	A	27.4	Very low	33.5	Very low	105 Å²	105	131.9 Å²	131.9	87%	0.868	78%	0.779	S	S	*	*			trans	91.7	157.7	163.3	0	0	0	0	0	120.9
780	Q	33.9	Very low	33.7	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	79%	0.79	S	S	*	*			trans	-80.5	174	175.8	-66	-178.9	-48.3	0	0	111.2
781	P	43.4	Very low	34.9	Very low	127 Å²	127	131.4 Å²	131.4	83%	0.825	78%	0.784	S	S	*	*			cis	-142.1	-160.7	17.5	41.1	-18.1	0	0	0	116.6
782	K	36.5	Very low	34.9	Very low	192 Å²	192	131.4 Å²	131.4	84%	0.835	78%	0.784	S	S	*	*			trans	-54.8	158.9	162.8	-108.6	-173.3	175.1	-178.8	0	111.8
783	P	41.8	Very low	34.6	Very low	120 Å²	120	134 Å²	134	78%	0.779	79%	0.792	S	S	*	*			cis	-147	-170.7	45.4	41.1	-19.6	0	0	0	117.8
784	S	31.8	Very low	34.6	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	78%	0.78	S	S	*	*			trans	-82.6	169.8	170.6	50.2	0	0	0	0	112.9
785	P	49.6	Very low	35.4	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	78%	0.782	S	S	*	*			cis	-138.9	-143.1	39.2	39.1	-13.7	0	0	0	113.5
786	S	31	Very low	35.4	Very low	93 Å²	93	130.1 Å²	130.1	65%	0.65	78%	0.777	S	S	*	*			cis	-164.6	141.6	5.9	33.1	0	0	0	0	115.5
787	H	34.8	Very low	35.2	Very low	171 Å²	171	134.2 Å²	134.2	79%	0.792	78%	0.782	S	S	*	*			trans	30.9	131.6	141.8	-60	-83.8	0	0	0	125.2
788	T	28.3	Very low	34.3	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	79%	0.787	S	S	*	*				171.2	163.7	107	33.6	0	0	0	0	112.4
789	S	27.3	Very low	35.2	Very low	92 Å²	92	138.3 Å²	138.3	64%	0.643	78%	0.781	S	S	*	*				-171.8	111.8	-55.4	50.2	0	0	0	0	115.4
790	I	30.9	Very low	35.1	Very low	167 Å²	167	140.2 Å²	140.2	86%	0.856	78%	0.776	S	S	*	*			trans	50.5	-170.6	150.7	22.7	176.4	0	0	0	118.2
791	P	53.7	Low	35	Very low	114 Å²	114	142 Å²	142	74%	0.74	78%	0.776	S	S	*	*			cis	-117.4	-171.6	-12.8	46	-32.6	0	0	0	112.3
792	H	33.5	Very low	34.1	Very low	161 Å²	161	143 Å²	143	75%	0.745	78%	0.775	S	S	*	*			cis	-135.8	-139.1	-9.8	-150	-25.3	0	0	0	108.8
793	T	25.9	Very low	33.8	Very low	125 Å²	125	139.7 Å²	139.7	77%	0.767	77%	0.77	S	S	*	*			cis	-130.3	-177	3.7	53.9	0	0	0	0	110.5
794	S	29	Very low	33	Very low	97 Å²	97	138.9 Å²	138.9	68%	0.678	77%	0.768	S	S	*	*			trans	-158.7	176.6	175.1	-53	0	0	0	0	110.6
795	P	44.7	Very low	32.6	Very low	106 Å²	106	143.8 Å²	143.8	69%	0.688	78%	0.776	S	S	*	*				-149.7	152.2	77.3	38.7	-19	0	0	0	118.7
796	Q	29.9	Very low	31.5	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	77%	0.774	S	S	*	*			trans	48.1	122.1	136.8	-62.7	163.7	-34.3	0	0	122.2
797	N	24.6	Very low	31.2	Very low	158 Å²	158	143.4 Å²	143.4	85%	0.845	78%	0.782	S	S	*	*				-158.5	133	94.2	-154.7	-9.5	0	0	0	113.2
798	R	32.6	Very low	30.9	Very low	234 Å²	234	144.5 Å²	144.5	88%	0.883	79%	0.79	S	S	*	*			trans	171.2	171.1	179.9	-110.5	-173.1	-176.4	-165.9	2.7	107.5
799	P	47.8	Very low	30.9	Very low	113 Å²	113	141.7 Å²	141.7	73%	0.734	79%	0.788	S	S	*	*			cis	-130.1	-169.8	-6.6	42.1	-26.5	0	0	0	112.9
800	N	26	Very low	30.8	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	80%	0.798	S	S	*	*			trans	-158.3	160	131.1	-149.4	-8.6	0	0	0	112.5
801	Y	30.8	Very low	30.6	Very low	226 Å²	226	137.2 Å²	137.2	89%	0.886	80%	0.797	S	S	*	*			trans	-146.6	125.8	167.1	-110.5	-79.6	0	0	0	107.6
802	N	26	Very low	29.4	Very low	148 Å²	148	137.1 Å²	137.1	79%	0.791	80%	0.8	S	S	*	*			trans	-153.8	171.2	169.3	-154.8	0.7	0	0	0	111.3
803	V	30.6	Very low	29.7	Very low	122 Å²	122	135.1 Å²	135.1	74%	0.739	80%	0.801	S	S	*	*			trans	-136.4	151.8	-158.2	-156.6	0	0	0	0	113.4
804	S	24.6	Very low	29.8	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	80%	0.801	S	S	*	*			trans	90	146.2	156.5	-62.1	0	0	0	0	121.6
805	F	23.9	Very low	29.8	Very low	206 Å²	206	134.8 Å²	134.8	90%	0.904	81%	0.81	S	S	*	*			trans	68.2	142.8	169.2	-92	-120	0	0	0	116.9
806	S	25.7	Very low	29	Very low	103 Å²	103	133.3 Å²	133.3	72%	0.72	81%	0.814	S	S	*	*			cis	-141.9	173.9	11.6	-65	0	0	0	0	113.2
807	A	25	Very low	29	Very low	99 Å²	99	131.7 Å²	131.7	82%	0.818	82%	0.817	S	S	*	*			trans	-67.5	163.7	163.5	0	0	0	0	0	111.6
808	M	28.4	Very low	29	Very low	194 Å²	194	133.4 Å²	133.4	96%	0.956	82%	0.817	S	S	*	*				-172	142.5	67.2	179.8	170.4	175.6	0	0	106.1
809	G	28.2	Very low	29.4	Very low	76 Å²	76	126.8 Å²	126.8	78%	0.784	80%	0.804	S	S	*	*			cis	136	146.4	35.6	0	0	0	0	0	105.7
810	G	26	Very low	28.4	Very low	84 Å²	84	129.8 Å²	129.8	87%	0.866	81%	0.808	S	S	*	*			cis	-151.7	-162	-1.4	0	0	0	0	0	110.6
811	G	25.9	Very low	28.4	Very low	81 Å²	81	127.9 Å²	127.9	84%	0.835	81%	0.813	S	S	*	*			cis	-148.5	157.3	3.5	0	0	0	0	0	113.4
812	S	29	Very low	28.1	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	81%	0.806	S	S	*	*			trans	-97.4	-171.4	172.3	-122.1	0	0	0	0	109.5
813	P	39.4	Very low	28.3	Very low	119 Å²	119	120.5 Å²	120.5	77%	0.773	81%	0.811	S	S	*	*			cis	-113.4	159.8	8.1	12.4	13.7	0	0	0	113
814	S	27.5	Very low	28.1	Very low	108 Å²	108	118.4 Å²	118.4	76%	0.755	81%	0.814	S	S	*	*			cis	75	112.2	46.2	-172	0	0	0	0	115.3
815	A	28.5	Very low	28.1	Very low	106 Å²	106	119.8 Å²	119.8	88%	0.876	82%	0.822	S	S	*	*			trans	-153.8	115.1	148.3	0	0	0	0	0	109.4
816	G	29.6	Very low	28.5	Very low	75 Å²	75	119 Å²	119	77%	0.773	82%	0.819	S	S	*	*			trans	-153.9	126.8	174.1	0	0	0	0	0	109.8
817	V	28.3	Very low	29.2	Very low	153 Å²	153	119.6 Å²	119.6	93%	0.927	82%	0.82	S	S	*	*			trans	-121	141.5	-173.5	-178.8	0	0	0	0	110.6
818	K	25.4	Very low	29.3	Very low	193 Å²	193	126.3 Å²	126.3	84%	0.839	82%	0.824	S	S	*	*			trans	-99.1	-175.6	-174	-110.5	177	-178.2	177.7	0	109.8
819	P	41.2	Very low	29.4	Very low	95 Å²	95	120.9 Å²	120.9	62%	0.617	81%	0.81	S	S	*	*			cis	-139.6	-168.5	-16.3	30.6	-7.2	0	0	0	114.5
820	Q	26.2	Very low	29.5	Very low	177 Å²	177	122.3 Å²	122.3	83%	0.827	81%	0.808	S	S	*	*			trans	78.9	111.5	138.4	-95.1	171.1	-39.3	0	0	123.2
821	A	26.9	Very low	30.1	Very low	104 Å²	104	127 Å²	127	86%	0.86	81%	0.813	S	S	*	*				30.8	125.4	125.5	0	0	0	0	0	121.8
822	G	24.7	Very low	30.8	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	81%	0.807	S	S	*	*			trans	-176.1	117.4	162.9	0	0	0	0	0	115.2
823	T	29	Very low	31.3	Very low	145 Å²	145	128.2 Å²	128.2	89%	0.89	80%	0.804	S	S	*	*			trans	9.9	110.7	153.3	54.2	0	0	0	0	121.5
824	G	26.6	Very low	31.2	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	81%	0.805	S	S	*	*				79.9	136.3	115.9	0	0	0	0	0	122.8
825	C	25.7	Very low	31.9	Very low	134 Å²	134	133.8 Å²	133.8	91%	0.905	81%	0.81	S	S	*	*			trans	94.1	165.7	161.8	-138.2	0	0	0	0	119.3
826	K	31.5	Very low	32.6	Very low	190 Å²	190	134.9 Å²	134.9	83%	0.826	80%	0.801	S	S	*	*			trans	-104.2	-173.9	-165.6	-34.6	169.6	-177.8	173	0	110.7
827	P	39.3	Very low	33.4	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	80%	0.799	S	S	*	*			cis	-131.6	179	-20.8	41.3	-26.4	0	0	0	113.7
828	R	27.7	Very low	34.2	Very low	241 Å²	241	138.7 Å²	138.7	91%	0.909	80%	0.797	S	S	*	*			trans	159.6	178.1	150	-91.9	167.8	-176.6	-160.6	0.6	109.4
829	A	30.5	Very low	35	Very low	80 Å²	80	133.7 Å²	133.7	66%	0.661	79%	0.786	S	S	*	*			cis	161	125.5	-48.1	0	0	0	0	0	109.5
830	S	31.2	Very low	35.1	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	78%	0.783	S	S	*	*			trans	52.3	103.4	165.2	59.3	0	0	0	0	120.3	A832	S830-A832 PolarHBondContact O-N 3.46Å; S830-A832 VanDerWaalsContact O-N 3.16Å
831	D	37.5	Very low	35.5	Very low	181 Å²	181	132.7 Å²	132.7	97%	0.968	79%	0.787	S	S	*	*			trans	-79.1	80.3	159.3	-67.9	-60.9	0	0	0	110.9
832	A	40.6	Very low	36	Very low	85 Å²	85	131.1 Å²	131.1	70%	0.702	78%	0.782	S	S	*	*			trans	-129.3	28.8	-178.2	0	0	0	0	0	112.8	S830	S830-A832 PolarHBondContact O-N 3.46Å; S830-A832 VanDerWaalsContact O-N 3.16Å
833	N	39.5	Very low	36.3	Very low	136 Å²	136	138.2 Å²	138.2	73%	0.727	79%	0.792	S	S	*	*			trans	-142.1	42.4	-162.6	-153.6	35.9	0	0	0	114.4
834	F	38.1	Very low	36.9	Very low	185 Å²	185	136.1 Å²	136.1	81%	0.811	79%	0.79	S	S	*	*	S	Bend	trans	-136.2	-11.8	171	-104.7	-79.7	0	0	0	114.9
835	D	42.8	Very low	37.1	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-70.9	-31.7	176.5	-129.3	-116.4	0	0	0	112.2	L837	D835-L837 PolarHBondContact O-N 3.47Å; D835-L837 VanDerWaalsContact O-N 3.15Å
836	D	43.3	Very low	37.9	Very low	129 Å²	129	136.6 Å²	136.6	69%	0.69	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-78.5	6.1	-170.9	-159.5	38.3	0	0	0	114.9
837	L	45.1	Very low	38.2	Very low	138 Å²	138	137.7 Å²	137.7	72%	0.723	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-111.1	2.8	-176.2	-87.7	168.5	0	0	0	115.1	D835	D835-L837 PolarHBondContact O-N 3.47Å; D835-L837 VanDerWaalsContact O-N 3.15Å
838	L	46.4	Very low	38.3	Very low	169 Å²	169	138.9 Å²	138.9	89%	0.885	79%	0.789	S	S	*	*	S	Bend	trans	-122.3	-1.9	176	-65.2	176.9	0	0	0	114.2	G840	L838-G840 PolarHBondContact O-N 2.8Å
839	S	41.8	Very low	38.8	Very low	89 Å²	89	137.7 Å²	137.7	62%	0.622	79%	0.791	S	S	*	*			trans	-76	-4.9	175.5	52.3	0	0	0	0	114.2	Q841	S839-Q841 PolarHBondContact O-N 3.36Å
840	G	43	Very low	39.2	Very low	53 Å²	53	141.7 Å²	141.7	55%	0.546	79%	0.793	S	S	.	*	S	Bend	trans	-86.1	-2	-152.4	0	0	0	0	0	120	L838	L838-G840 PolarHBondContact O-N 2.8Å
841	Q	35.4	Very low	40.3	Very low	197 Å²	197	139.2 Å²	139.2	92%	0.921	78%	0.784	S	S	*	*	S	Bend	trans	-160.7	119.8	170.2	-104	118.3	64.9	0	0	111.5	S839	S839-Q841 PolarHBondContact O-N 3.36Å
842	G	36.6	Very low	40.7	Very low	72 Å²	72	137 Å²	137	74%	0.742	78%	0.779	S	S	*	*			trans	-102.8	136.5	-175.4	0	0	0	0	0	114.4
843	F	31.2	Very low	41.5	Very low	221 Å²	221	140.5 Å²	140.5	97%	0.969	77%	0.774	S	S	*	*				-159	160.5	128.8	-122.9	-88.6	0	0	0	109.9
844	A	40.3	Very low	42.5	Very low	101 Å²	101	137.7 Å²	137.7	84%	0.835	76%	0.762	S	S	*	*			trans	-82.6	155.6	-167.3	0	0	0	0	0	115
845	G	30.6	Very low	43.2	Very low	78 Å²	78	134.5 Å²	134.5	80%	0.804	75%	0.752	S	S	*	*			trans	-178.7	110.7	169.7	0	0	0	0	0	114.3
846	T	43.3	Very low	43.6	Very low	145 Å²	145	130.4 Å²	130.4	89%	0.89	74%	0.741	S	S	*	*			trans	-75.9	139.1	174	42.2	0	0	0	0	112.1
847	K	37.3	Very low	44.2	Very low	212 Å²	212	129.2 Å²	129.2	92%	0.922	73%	0.731	S	S	*	*			trans	-142.3	131.3	153.7	-77.6	-161.7	174.4	177.5	0	111.9
848	E	42.7	Very low	44.4	Very low	139 Å²	139	127.7 Å²	127.7	65%	0.65	72%	0.721	S	S	*	*			trans	-75.2	161.7	176.8	-52.7	179.1	134.5	0	0	112.3	K850	E848-K850 IonicContact OE1-NZ 3.96Å; E848-K850 PolarHBondContact OE1-NZ 3.06Å; E848-K850 IonicContact OE2-NZ 2.65Å; E848-K850 PolarHBondContact OE2-NZ 3.1Å
849	K	36.9	Very low	44.7	Very low	217 Å²	217	128 Å²	128	94%	0.943	71%	0.711	S	S	*	*			trans	-127.5	94.7	145.4	-79.7	-171.8	175.1	178.8	0	109.6	G851	K849-G851 PolarHBondContact O-N 3.42Å
850	K	40	Very low	45.4	Very low	164 Å²	164	131.6 Å²	131.6	71%	0.713	72%	0.715	S	S	*	*			trans	-73.6	120.1	170.5	-73.1	-168.1	173.8	89.2	0	110.3	E848	E848-K850 IonicContact OE1-NZ 3.96Å; E848-K850 PolarHBondContact OE1-NZ 3.06Å; E848-K850 IonicContact OE2-NZ 2.65Å; E848-K850 PolarHBondContact OE2-NZ 3.1Å
851	G	54.5	Low	45.8	Very low	53 Å²	53	133.8 Å²	133.8	55%	0.546	71%	0.711	S	S	.	*			trans	-106.3	154.5	144.4	0	0	0	0	0	108.7	K849 R853	K849-G851 PolarHBondContact O-N 3.42Å; G851-R853 PolarHBondContact O-N 2.72Å
852	P	46	Very low	46.5	Very low	134 Å²	134	130 Å²	130	87%	0.87	69%	0.694	S	S	*	*			trans	-71.1	101.7	177.8	28.9	-33.1	0	0	0	110.4
853	R	57.2	Low	47.2	Very low	160 Å²	160	133 Å²	133	60%	0.604	69%	0.69	S	S	*	*			trans	-62.3	141.8	169.9	-56.8	-172.8	-149.8	-161.4	2.9	109.5	G851 E861	G851-R853 PolarHBondContact O-N 2.72Å; R853-E861 IonicContact CZ-OE1 3.97Å; R853-E861 IonicContact CZ-OE2 3.72Å; R853-E861 IonicContact NH1-OE1 2.68Å; R853-E861 PolarHBondContact NH1-OE1 3.32Å; R853-E861 IonicContact NH1-OE2 3.68Å; R853-E861 PolarHBondContact NH1-OE2 2.94Å
854	T	60.7	Low	48.2	Very low	76 Å²	76	125.2 Å²	125.2	47%	0.466	67%	0.666	S	S	.	*			trans	-77	153.2	174.4	60.5	0	0	0	0	111.4	A856 E857 M858	T854-A856 PolarHBondContact O-N 3.4Å; T854-E857 WeakPolarHBondContact CB-OE2 3.27Å; T854-E857 PolarHBondContact N-OE2 3.34Å; T854-E857 WeakPolarHBondContact O-CB 3.49Å; T854-E857 PolarHBondContact O-N 3.25Å; T854-E857 VanDerWaalsContact O-N 3.07Å; T854-E857 WeakPolarHBondContact OG1-CG 3.41Å; T854-E857 PolarHBondContact OG1-N 3.15Å; T854-E857 PolarHBondContact OG1-OE2 3.18Å; T854-M858 PolarHBondContact O-N 3.45Å
855	I	52.7	Low	48.9	Very low	119 Å²	119	129.3 Å²	129.3	61%	0.61	67%	0.665	S	S	*	*	H	α-helix	trans	-59.8	-28.4	175.8	-60.1	174.3	0	0	0	111.1	R859	I855-R859 WeakPolarHBondContact O-CG 3.44Å; I855-R859 PolarHBondContact O-N 2.76Å; I855-R859 VanDerWaalsContact O-N 3.15Å
856	A	51.4	Low	50	Low	73 Å²	73	133.8 Å²	133.8	60%	0.603	67%	0.665	S	S	*	*	H	α-helix	trans	-71.7	-40.3	174.5	0	0	0	0	0	112.9	T854 K860	T854-A856 PolarHBondContact O-N 3.4Å; A856-K860 VanDerWaalsContact O-CB 3.26Å; A856-K860 WeakPolarHBondContact O-CB 3.35Å; A856-K860 PolarHBondContact O-N 3.35Å
857	E	54.8	Low	50.6	Low	103 Å²	103	129.1 Å²	129.1	48%	0.481	63%	0.634	S	S	.	*	H	α-helix	trans	-62	-48.9	169.9	-79.2	163.8	117.5	0	0	110.9	T854 R859 K860 E861	T854-E857 WeakPolarHBondContact CB-OE2 3.27Å; T854-E857 PolarHBondContact N-OE2 3.34Å; T854-E857 WeakPolarHBondContact O-CB 3.49Å; T854-E857 PolarHBondContact O-N 3.25Å; T854-E857 VanDerWaalsContact O-N 3.07Å; T854-E857 WeakPolarHBondContact OG1-CG 3.41Å; T854-E857 PolarHBondContact OG1-N 3.15Å; T854-E857 PolarHBondContact OG1-OE2 3.18Å; E857-R859 VanDerWaalsContact C-N 3.33Å; E857-R859 PolarHBondContact O-N 3.23Å; E857-K860 CarbonylContact O-C 3.55Å; E857-K860 WeakPolarHBondContact O-CA 3.27Å; E857-K860 PolarHBondContact O-N 2.89Å; E857-E861 VanDerWaalsContact O-CB 3.28Å; E857-E861 WeakPolarHBondContact O-CB 3.37Å; E857-E861 PolarHBondContact O-N 3.41Å
858	M	49	Very low	52	Low	106 Å²	106	123.2 Å²	123.2	52%	0.522	61%	0.612	S	S	.	*	H	α-helix	trans	-60.1	-43.2	-175	-153.7	170.1	77.6	0	0	111.8	T854 E861 E862	T854-M858 PolarHBondContact O-N 3.45Å; M858-E861 PolarHBondContact O-N 3.49Å; M858-E862 WeakPolarHBondContact O-CG 3.49Å; M858-E862 PolarHBondContact O-N 3.31Å
859	R	54.1	Low	53.4	Low	176 Å²	176	120.9 Å²	120.9	66%	0.664	61%	0.609	S	S	*	*	H	α-helix	trans	-67.8	-34.2	173.5	-73.2	176.3	174.7	161.1	-0.5	113.6	I855 E857 M863	I855-R859 WeakPolarHBondContact O-CG 3.44Å; I855-R859 PolarHBondContact O-N 2.76Å; I855-R859 VanDerWaalsContact O-N 3.15Å; E857-R859 VanDerWaalsContact C-N 3.33Å; E857-R859 PolarHBondContact O-N 3.23Å; R859-M863 VanDerWaalsContact O-CB 3.29Å; R859-M863 WeakPolarHBondContact O-CB 3.2Å; R859-M863 PolarHBondContact O-N 3.42Å
860	K	54.6	Low	55.2	Low	164 Å²	164	113.6 Å²	113.6	71%	0.713	58%	0.578	S	S	*	*	H	α-helix	trans	-71.6	-33.9	175.6	-172.9	-179.3	178.2	-171.5	0	111.5	A856 E857 A864	A856-K860 VanDerWaalsContact O-CB 3.26Å; A856-K860 WeakPolarHBondContact O-CB 3.35Å; A856-K860 PolarHBondContact O-N 3.35Å; E857-K860 CarbonylContact O-C 3.55Å; E857-K860 WeakPolarHBondContact O-CA 3.27Å; E857-K860 PolarHBondContact O-N 2.89Å; K860-A864 VanDerWaalsContact O-CB 3.25Å; K860-A864 WeakPolarHBondContact O-CB 3.44Å; K860-A864 PolarHBondContact O-N 3.22Å
861	E	52.6	Low	57	Low	99 Å²	99	108.3 Å²	108.3	46%	0.463	56%	0.556	S	S	.	*	H	α-helix	trans	-75.5	-38.3	178.4	-164	176.6	172.6	0	0	111.2	R853 E857 M858 A864 K865	R853-E861 IonicContact CZ-OE1 3.97Å; R853-E861 IonicContact CZ-OE2 3.72Å; R853-E861 IonicContact NH1-OE1 2.68Å; R853-E861 PolarHBondContact NH1-OE1 3.32Å; R853-E861 IonicContact NH1-OE2 3.68Å; R853-E861 PolarHBondContact NH1-OE2 2.94Å; E857-E861 VanDerWaalsContact O-CB 3.28Å; E857-E861 WeakPolarHBondContact O-CB 3.37Å; E857-E861 PolarHBondContact O-N 3.41Å; M858-E861 PolarHBondContact O-N 3.49Å; E861-A864 PolarHBondContact O-N 3.48Å; E861-K865 VanDerWaalsContact O-CB 3.28Å; E861-K865 WeakPolarHBondContact O-CB 3.2Å; E861-K865 PolarHBondContact O-N 3.43Å
862	E	50.4	Low	58.2	Low	119 Å²	119	108.9 Å²	108.9	56%	0.556	55%	0.545	S	S	*	.	H	α-helix	trans	-58.7	-53	165.5	-75.3	177.7	128.9	0	0	111.1	M858 A864 K865 E866	M858-E862 WeakPolarHBondContact O-CG 3.49Å; M858-E862 PolarHBondContact O-N 3.31Å; E862-A864 VanDerWaalsContact C-N 3.26Å; E862-A864 PolarHBondContact O-N 3.21Å; E862-K865 WeakPolarHBondContact O-CB 3.21Å; E862-K865 PolarHBondContact O-N 3.04Å; E862-E866 PolarHBondContact O-N 2.9Å
863	M	51.5	Low	59.9	Low	134 Å²	134	107.5 Å²	107.5	66%	0.66	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-30	-179	-165.5	178	-160.7	0	0	113.3	R859 M867	R859-M863 VanDerWaalsContact O-CB 3.29Å; R859-M863 WeakPolarHBondContact O-CB 3.2Å; R859-M863 PolarHBondContact O-N 3.42Å; M863-M867 WeakPolarHBondContact O-CG 3.33Å
864	A	52.1	Low	61.3	Low	57 Å²	57	100 Å²	100	47%	0.471	50%	0.497	S	S	.	.	H	α-helix	trans	-76.8	-25	173.1	0	0	0	0	0	113.1	K860 E861 E862	K860-A864 VanDerWaalsContact O-CB 3.25Å; K860-A864 WeakPolarHBondContact O-CB 3.44Å; K860-A864 PolarHBondContact O-N 3.22Å; E861-A864 PolarHBondContact O-N 3.48Å; E862-A864 VanDerWaalsContact C-N 3.26Å; E862-A864 PolarHBondContact O-N 3.21Å
865	K	53.5	Low	62.2	Low	188 Å²	188	99.9 Å²	99.9	82%	0.817	49%	0.493	S	S	*	.	H	α-helix	trans	-81.9	-17.6	179.8	-163.9	175.6	-177.5	-174.6	0	113.3	E861 E862	E861-K865 VanDerWaalsContact O-CB 3.28Å; E861-K865 WeakPolarHBondContact O-CB 3.2Å; E861-K865 PolarHBondContact O-N 3.43Å; E862-K865 WeakPolarHBondContact O-CB 3.21Å; E862-K865 PolarHBondContact O-N 3.04Å
866	E	53.9	Low	63.7	Low	172 Å²	172	99 Å²	99	80%	0.804	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	5	170.6	-65.2	-169.1	136.5	0	0	113.8	E862	E862-E866 PolarHBondContact O-N 2.9Å
867	M	56.4	Low	65.4	Low	47 Å²	47	95.8 Å²	95.8	23%	0.232	46%	0.463	C	S	.	.	S	Bend	trans	-97.7	123	-178.6	-84.3	-176.7	31.4	0	0	113.1	M863 K871 I872 L875	M863-M867 WeakPolarHBondContact O-CG 3.33Å; M867-K871 HydrophobicContact CB-CD 4.49Å; M867-K871 HydrophobicContact CE-CD 4.29Å; M867-K871 HydrophobicContact CE-CG 4.36Å; M867-K871 HydrophobicContact CG-CD 4.01Å; M867-K871 HydrophobicContact SD-CD 4.38Å; M867-I872 HydrophobicContact CB-CG1 4.42Å; M867-I872 HydrophobicContact CE-CG1 3.91Å; M867-L875 HydrophobicContact CE-CD1 3.57Å
868	D	66.5	Low	66.9	Low	88 Å²	88	92 Å²	92	47%	0.471	45%	0.445	S	S	.	.			trans	-53.5	142.9	174.2	-65.8	-79.6	0	0	0	113.2	E870 K871 I872 Y941	D868-E870 PolarHBondContact O-N 2.88Å; D868-K871 HydrophobicContact CB-CB 4.33Å; D868-K871 VanDerWaalsContact O-CB 3.27Å; D868-K871 WeakPolarHBondContact O-CB 3.37Å; D868-K871 PolarHBondContact O-N 3.11Å; D868-I872 PolarHBondContact O-N 3.42Å; D868-Y941 WeakPolarHBondContact CB-OH 3.48Å; D868-Y941 VanDerWaalsContact CG-OH 3.28Å
869	P	72.9	Confident	68.5	Low	90 Å²	90	93.8 Å²	93.8	58%	0.584	45%	0.452	S	S	*	.	H	α-helix	trans	-63	-26.8	-178	25.7	-34.8	0	0	0	113	K873	P869-K873 WeakPolarHBondContact O-CG 3.37Å; P869-K873 PolarHBondContact O-N 3.13Å; P869-K873 VanDerWaalsContact O-N 3.14Å
870	E	73.8	Confident	69.5	Low	63 Å²	63	89.1 Å²	89.1	29%	0.294	46%	0.459	S	S	.	.	H	α-helix	trans	-71.9	-35	175.2	-56.9	-159.7	130.7	0	0	112.4	D868 I872 K873 I874 Y941	D868-E870 PolarHBondContact O-N 2.88Å; E870-I872 VanDerWaalsContact C-N 3.31Å; E870-I872 PolarHBondContact O-N 3.01Å; E870-K873 PolarHBondContact O-N 2.94Å; E870-I874 WeakPolarHBondContact O-CD1 3.42Å; E870-I874 WeakPolarHBondContact O-CG1 3.41Å; E870-I874 PolarHBondContact O-N 2.83Å; E870-I874 VanDerWaalsContact O-N 3.08Å; E870-Y941 HydrophobicContact CB-CD2 4.18Å; E870-Y941 HydrophobicContact CB-CE1 4.35Å; E870-Y941 HydrophobicContact CB-CE2 3.79Å; E870-Y941 HydrophobicContact CG-CE2 4.43Å; E870-Y941 WeakPolarHBondContact OE2-CE2 3.42Å
871	K	78	Confident	70.8	Confident	54 Å²	54	83.7 Å²	83.7	24%	0.235	44%	0.435	C	S	.	.	H	α-helix	trans	-63.8	-38.4	174.8	-163.9	178.2	176	-175.6	0	111.6	M867 D868 I874 L875 Y941 M944	M867-K871 HydrophobicContact CB-CD 4.49Å; M867-K871 HydrophobicContact CE-CD 4.29Å; M867-K871 HydrophobicContact CE-CG 4.36Å; M867-K871 HydrophobicContact CG-CD 4.01Å; M867-K871 HydrophobicContact SD-CD 4.38Å; D868-K871 HydrophobicContact CB-CB 4.33Å; D868-K871 VanDerWaalsContact O-CB 3.27Å; D868-K871 WeakPolarHBondContact O-CB 3.37Å; D868-K871 PolarHBondContact O-N 3.11Å; K871-I874 PolarHBondContact O-N 2.79Å; K871-L875 WeakPolarHBondContact O-CG 3.15Å; K871-L875 PolarHBondContact O-N 2.97Å; K871-L875 VanDerWaalsContact O-N 3.14Å; K871-Y941 HydrophobicContact CB-CE1 3.94Å; K871-M944 HydrophobicContact CG-CE 4.31Å; K871-M944 HydrophobicContact CG-SD 4.23Å
872	I	79.6	Confident	72	Confident	65 Å²	65	84.1 Å²	84.1	33%	0.333	44%	0.437	S	S	.	.	H	α-helix	trans	-66.2	-50.6	175.3	-60.8	172.4	0	0	0	110	M867 D868 E870 I874 L875 D876	M867-I872 HydrophobicContact CB-CG1 4.42Å; M867-I872 HydrophobicContact CE-CG1 3.91Å; D868-I872 PolarHBondContact O-N 3.42Å; E870-I872 VanDerWaalsContact C-N 3.31Å; E870-I872 PolarHBondContact O-N 3.01Å; I872-I874 PolarHBondContact O-N 2.93Å; I872-I874 VanDerWaalsContact O-N 3.11Å; I872-L875 PolarHBondContact O-N 2.77Å; I872-D876 PolarHBondContact O-N 3.2Å
873	K	82.6	Confident	73.1	Confident	105 Å²	105	84.1 Å²	84.1	46%	0.457	43%	0.432	S	S	.	.	H	α-helix	trans	-51.2	-37.6	174.8	-69.7	172.2	-170.7	172.6	0	112.9	P869 E870 W877 V895	P869-K873 WeakPolarHBondContact O-CG 3.37Å; P869-K873 PolarHBondContact O-N 3.13Å; P869-K873 VanDerWaalsContact O-N 3.14Å; E870-K873 PolarHBondContact O-N 2.94Å; K873-W877 WeakPolarHBondContact O-CB 3.4Å; K873-W877 PolarHBondContact O-N 3.37Å; K873-W877 VanDerWaalsContact O-N 3.12Å; K873-V895 WeakPolarHBondContact O-CG1 3.35Å
874	I	85.8	Confident	74.8	Confident	2 Å²	2	81.6 Å²	81.6	1%	0.01	42%	0.421	C	S	.	.	H	α-helix	trans	-70.6	-45.2	177.8	-67.6	160.5	0	0	0	111.2	E870 K871 I872 W877 I878 V895 Y941 M944 I945	E870-I874 WeakPolarHBondContact O-CD1 3.42Å; E870-I874 WeakPolarHBondContact O-CG1 3.41Å; E870-I874 PolarHBondContact O-N 2.83Å; E870-I874 VanDerWaalsContact O-N 3.08Å; K871-I874 PolarHBondContact O-N 2.79Å; I872-I874 PolarHBondContact O-N 2.93Å; I872-I874 VanDerWaalsContact O-N 3.11Å; I874-W877 WeakPolarHBondContact O-CB 3.42Å; I874-W877 PolarHBondContact O-N 3.37Å; I874-I878 HydrophobicContact CG2-CD1 4.16Å; I874-I878 WeakPolarHBondContact O-CG1 3.44Å; I874-I878 PolarHBondContact O-N 3.38Å; I874-V895 HydrophobicContact CG1-CB 4.03Å; I874-V895 HydrophobicContact CG1-CG1 4.38Å; I874-Y941 HydrophobicContact CD1-CD1 3.75Å; I874-Y941 HydrophobicContact CD1-CG 3.8Å; I874-M944 HydrophobicContact CG2-CB 4.25Å; I874-M944 HydrophobicContact CG2-CE 3.96Å; I874-I945 HydrophobicContact CD1-CD1 4.1Å; I874-I945 HydrophobicContact CD1-CG1 4.29Å; I874-I945 HydrophobicContact CG1-CD1 4.19Å; I874-I945 HydrophobicContact CG1-CG1 4.25Å; I874-I945 HydrophobicContact CG2-CG1 4.1Å
875	L	79.9	Confident	76.7	Confident	73 Å²	73	79 Å²	79	38%	0.382	40%	0.4	S	S	.	.	H	α-helix	trans	-63.2	-46.1	178.2	-68.7	166.9	0	0	0	111.6	M867 K871 I872 W877 I878 E879 M944	M867-L875 HydrophobicContact CE-CD1 3.57Å; K871-L875 WeakPolarHBondContact O-CG 3.15Å; K871-L875 PolarHBondContact O-N 2.97Å; K871-L875 VanDerWaalsContact O-N 3.14Å; I872-L875 PolarHBondContact O-N 2.77Å; L875-W877 PolarHBondContact O-N 2.96Å; L875-I878 PolarHBondContact O-N 3.19Å; L875-I878 VanDerWaalsContact O-N 3.12Å; L875-E879 PolarHBondContact O-N 3.47Å; L875-M944 HydrophobicContact CD2-CE 3.99Å; L875-M944 HydrophobicContact CG-CE 4.17Å
876	D	84.1	Confident	78.4	Confident	102 Å²	102	71.2 Å²	71.2	55%	0.545	37%	0.365	S	S	.	.	H	α-helix	trans	-62.7	-25.9	175.8	-61	-4.6	0	0	0	112.3	I872	I872-D876 PolarHBondContact O-N 3.2Å
877	W	87.9	Confident	80	Confident	5 Å²	5	63.9 Å²	63.9	2%	0.019	33%	0.334	C	S	.	.	H	α-helix	trans	-81.1	-29.4	176.2	169.6	94.2	0	0	0	113.3	K873 I874 L875 K881 L888 T891 M892 V895 I945 L949	K873-W877 WeakPolarHBondContact O-CB 3.4Å; K873-W877 PolarHBondContact O-N 3.37Å; K873-W877 VanDerWaalsContact O-N 3.12Å; I874-W877 WeakPolarHBondContact O-CB 3.42Å; I874-W877 PolarHBondContact O-N 3.37Å; L875-W877 PolarHBondContact O-N 2.96Å; W877-K881 WeakPolarHBondContact O-CD 3.17Å; W877-K881 VanDerWaalsContact O-CE 3.29Å; W877-K881 WeakPolarHBondContact O-CE 3.46Å; W877-K881 PolarHBondContact O-NZ 3.2Å; W877-L888 HydrophobicContact CD2-CD2 4.36Å; W877-L888 HydrophobicContact CE3-CD2 4.2Å; W877-L888 HydrophobicContact CH2-CB 4.07Å; W877-L888 HydrophobicContact CH2-CD2 3.72Å; W877-L888 HydrophobicContact CH2-CG 4.45Å; W877-L888 HydrophobicContact CZ2-CB 4.02Å; W877-L888 HydrophobicContact CZ2-CD2 3.91Å; W877-L888 WeakPolarHBondContact CZ2-O 3.44Å; W877-L888 HydrophobicContact CZ3-CD2 3.88Å; W877-T891 PolarHBondContact NE1-O 2.96Å; W877-T891 PolarHBondContact NE1-OG1 2.7Å; W877-T891 VanDerWaalsContact NE1-OG1 3.08Å; W877-M892 HydrophobicContact CH2-CG 4.48Å; W877-M892 HydrophobicContact CZ2-CB 3.98Å; W877-M892 HydrophobicContact CZ2-CG 4.1Å; W877-V895 HydrophobicContact CB-CG1 3.39Å; W877-V895 HydrophobicContact CD2-CB 4.43Å; W877-V895 HydrophobicContact CD2-CG1 4.03Å; W877-V895 HydrophobicContact CD2-CG2 3.6Å; W877-V895 HydrophobicContact CE3-CG2 3.97Å; W877-V895 HydrophobicContact CG-CB 4.31Å; W877-V895 HydrophobicContact CG-CG1 3.44Å; W877-V895 VanDerWaalsContact CG-CG1 3.44Å; W877-V895 HydrophobicContact CG-CG2 3.9Å; W877-V895 HydrophobicContact CH2-CG2 4.43Å; W877-V895 HydrophobicContact CZ2-CG2 4.07Å; W877-V895 HydrophobicContact CZ3-CG2 4.38Å; W877-I945 HydrophobicContact CH2-CG2 4.07Å; W877-I945 HydrophobicContact CZ3-CG2 4.28Å; W877-L949 HydrophobicContact CH2-CD2 4.48Å
878	I	86.3	Confident	81.6	Confident	22 Å²	22	61.6 Å²	61.6	11%	0.113	32%	0.323	C	S	.	.	H	α-helix	trans	-75.5	-41.8	172	-63.9	176.3	0	0	0	110.2	I874 L875 G880 K881 E882 E948	I874-I878 HydrophobicContact CG2-CD1 4.16Å; I874-I878 WeakPolarHBondContact O-CG1 3.44Å; I874-I878 PolarHBondContact O-N 3.38Å; L875-I878 PolarHBondContact O-N 3.19Å; L875-I878 VanDerWaalsContact O-N 3.12Å; I878-G880 PolarHBondContact O-N 3.31Å; I878-K881 CarbonylContact O-C 3.5Å; I878-K881 WeakPolarHBondContact O-CA 3.09Å; I878-K881 PolarHBondContact O-N 3.24Å; I878-E882 HydrophobicContact CG2-CG 3.66Å; I878-E882 PolarHBondContact O-N 3.38Å; I878-E948 HydrophobicContact CD1-CB 3.98Å; I878-E948 HydrophobicContact CD1-CG 4.08Å; I878-E948 HydrophobicContact CG1-CB 4.4Å; I878-E948 HydrophobicContact CG1-CG 4.02Å; I878-E948 HydrophobicContact CG2-CG 4.12Å
879	E	81.9	Confident	82.8	Confident	145 Å²	145	57.4 Å²	57.4	68%	0.678	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	125.9	-173.9	-171.9	168.8	-148.5	0	0	111.9	L875 K881	L875-E879 PolarHBondContact O-N 3.47Å; E879-K881 PolarHBondContact O-N 2.95Å; E879-K881 VanDerWaalsContact O-N 3.1Å
880	G	75.2	Confident	83.6	Confident	78 Å²	78	53.8 Å²	53.8	80%	0.804	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	-7.5	-176.7	0	0	0	0	0	116	I878	I878-G880 PolarHBondContact O-N 3.31Å
881	K	82.3	Confident	84.3	Confident	50 Å²	50	52.8 Å²	52.8	22%	0.217	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-8.5	172.5	-60.8	-173.9	-133.3	137.7	0	114	W877 I878 E879 R883 N884 A887 L888 T891	W877-K881 WeakPolarHBondContact O-CD 3.17Å; W877-K881 VanDerWaalsContact O-CE 3.29Å; W877-K881 WeakPolarHBondContact O-CE 3.46Å; W877-K881 PolarHBondContact O-NZ 3.2Å; I878-K881 CarbonylContact O-C 3.5Å; I878-K881 WeakPolarHBondContact O-CA 3.09Å; I878-K881 PolarHBondContact O-N 3.24Å; E879-K881 PolarHBondContact O-N 2.95Å; E879-K881 VanDerWaalsContact O-N 3.1Å; K881-R883 PolarHBondContact O-N 3.19Å; K881-N884 WeakPolarHBondContact O-CB 3.43Å; K881-N884 PolarHBondContact O-N 2.98Å; K881-A887 HydrophobicContact CB-CB 4.39Å; K881-A887 HydrophobicContact CD-CB 4.2Å; K881-A887 HydrophobicContact CG-CB 4.25Å; K881-L888 HydrophobicContact CB-CD2 3.78Å; K881-L888 HydrophobicContact CB-CG 4.28Å; K881-T891 PolarHBondContact NZ-OG1 3.32Å; K881-T891 VanDerWaalsContact NZ-OG1 3.09Å
882	E	76.7	Confident	84.8	Confident	107 Å²	107	50.2 Å²	50.2	50%	0.5	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-32	132.9	169.5	-70.5	176	-147.7	0	0	111.9	I878 N884 E948	I878-E882 HydrophobicContact CG2-CG 3.66Å; I878-E882 PolarHBondContact O-N 3.38Å; E882-N884 PolarHBondContact O-N 3.31Å; E882-E948 WeakPolarHBondContact CA-OE1 3.46Å
883	R	74.6	Confident	85.1	Confident	120 Å²	120	51.5 Å²	51.5	45%	0.453	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-9.7	177.4	-50.9	150.6	-175.9	-67.2	-21.8	115.7	K881 I885 E948 E955	K881-R883 PolarHBondContact O-N 3.19Å; R883-I885 PolarHBondContact O-N 3.37Å; R883-E948 PolarHBondContact N-OE1 3.13Å; R883-E955 VanDerWaalsContact CD-OE2 3.22Å; R883-E955 WeakPolarHBondContact CD-OE2 3.38Å; R883-E955 VanDerWaalsContact CG-OE2 3.28Å; R883-E955 WeakPolarHBondContact CG-OE2 3.49Å; R883-E955 IonicContact CZ-OE2 2.75Å; R883-E955 IonicContact NE-OE2 3.05Å; R883-E955 IonicContact NH1-OE2 2.66Å; R883-E955 PolarHBondContact NH1-OE2 3.5Å
884	N	86.8	Confident	85.3	Confident	80 Å²	80	50.4 Å²	50.4	43%	0.428	27%	0.271	S	S	.	.			trans	-92.7	80.3	177.5	-173.1	-9.7	0	0	0	111.1	K881 E882 R886 A887 L888	K881-N884 WeakPolarHBondContact O-CB 3.43Å; K881-N884 PolarHBondContact O-N 2.98Å; E882-N884 PolarHBondContact O-N 3.31Å; N884-R886 PolarHBondContact O-N 2.7Å; N884-R886 PolarHBondContact OD1-N 3.08Å; N884-A887 HydrophobicContact CB-CB 4.08Å; N884-A887 PolarHBondContact O-N 3.13Å; N884-A887 PolarHBondContact OD1-N 3.18Å; N884-L888 PolarHBondContact O-N 3.36Å
885	I	91.1	Very high	85.4	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-51.9	-29.6	-177.5	-167.7	57.2	0	0	0	114.1	R883 L889 V917 Y921 L949 A952 W953 F956	R883-I885 PolarHBondContact O-N 3.37Å; I885-L889 HydrophobicContact CD1-CD1 4.07Å; I885-L889 HydrophobicContact CD1-CG 4.01Å; I885-L889 HydrophobicContact CG1-CD1 3.82Å; I885-L889 HydrophobicContact CG1-CG 4.22Å; I885-L889 VanDerWaalsContact O-CB 3.3Å; I885-L889 WeakPolarHBondContact O-CB 3.43Å; I885-L889 WeakPolarHBondContact O-CG 3.07Å; I885-L889 PolarHBondContact O-N 3.28Å; I885-V917 HydrophobicContact CG1-CG1 4.29Å; I885-V917 HydrophobicContact CG2-CG1 3.92Å; I885-Y921 HydrophobicContact CD1-CD2 4.08Å; I885-L949 HydrophobicContact CD1-CD2 3.85Å; I885-A952 HydrophobicContact CB-CB 4.09Å; I885-A952 HydrophobicContact CD1-CB 4.14Å; I885-W953 HydrophobicContact CD1-CB 4.29Å; I885-W953 HydrophobicContact CG1-CB 4.46Å; I885-W953 HydrophobicContact CG1-CE3 4.28Å; I885-F956 HydrophobicContact CG2-CB 3.68Å; I885-F956 HydrophobicContact CG2-CD1 4.17Å; I885-F956 HydrophobicContact CG2-CD2 4.14Å; I885-F956 HydrophobicContact CG2-CG 3.73Å
886	R	89.6	Confident	85.7	Confident	23 Å²	23	48.8 Å²	48.8	9%	0.087	26%	0.263	C	S	.	.	H	α-helix	trans	-73.6	-41.8	177.8	-67.4	-179.3	165.4	111	-7	112.3	N884 S890 M908 L911 V912 V917 K962	N884-R886 PolarHBondContact O-N 2.7Å; N884-R886 PolarHBondContact OD1-N 3.08Å; R886-S890 WeakPolarHBondContact O-CB 3.45Å; R886-S890 PolarHBondContact O-N 3.36Å; R886-S890 VanDerWaalsContact O-N 3.09Å; R886-S890 PolarHBondContact O-OG 3.3Å; R886-M908 HydrophobicContact CB-CE 4.09Å; R886-M908 HydrophobicContact CB-SD 4.07Å; R886-L911 HydrophobicContact CG-CB 4.36Å; R886-L911 PolarHBondContact NE-O 2.98Å; R886-V912 PolarHBondContact NH2-O 2.88Å; R886-V917 HydrophobicContact CG-CG2 3.93Å; R886-K962 PolarHBondContact NH1-O 2.89Å; R886-K962 PolarHBondContact NH2-O 3.48Å
887	A	88.4	Confident	85.7	Confident	18 Å²	18	45.1 Å²	45.1	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-68.5	-39	176.3	0	0	0	0	0	111.7	K881 N884 S890 T891	K881-A887 HydrophobicContact CB-CB 4.39Å; K881-A887 HydrophobicContact CD-CB 4.2Å; K881-A887 HydrophobicContact CG-CB 4.25Å; N884-A887 HydrophobicContact CB-CB 4.08Å; N884-A887 PolarHBondContact O-N 3.13Å; N884-A887 PolarHBondContact OD1-N 3.18Å; A887-S890 PolarHBondContact O-OG 3.36Å; A887-T891 PolarHBondContact O-N 3.13Å; A887-T891 VanDerWaalsContact O-N 3.14Å; A887-T891 PolarHBondContact O-OG1 3.41Å
888	L	90.4	Very high	84.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-56.8	174.9	-64.3	168.1	0	0	0	110.5	W877 K881 N884 S890 T891 M892 E948 L949 A952	W877-L888 HydrophobicContact CD2-CD2 4.36Å; W877-L888 HydrophobicContact CE3-CD2 4.2Å; W877-L888 HydrophobicContact CH2-CB 4.07Å; W877-L888 HydrophobicContact CH2-CD2 3.72Å; W877-L888 HydrophobicContact CH2-CG 4.45Å; W877-L888 HydrophobicContact CZ2-CB 4.02Å; W877-L888 HydrophobicContact CZ2-CD2 3.91Å; W877-L888 WeakPolarHBondContact CZ2-O 3.44Å; W877-L888 HydrophobicContact CZ3-CD2 3.88Å; K881-L888 HydrophobicContact CB-CD2 3.78Å; K881-L888 HydrophobicContact CB-CG 4.28Å; N884-L888 PolarHBondContact O-N 3.36Å; L888-S890 VanDerWaalsContact C-N 3.33Å; L888-S890 PolarHBondContact O-N 3.43Å; L888-T891 CarbonylContact O-C 3.54Å; L888-T891 PolarHBondContact O-N 2.97Å; L888-T891 VanDerWaalsContact O-N 3.15Å; L888-M892 WeakPolarHBondContact O-CB 3.37Å; L888-M892 PolarHBondContact O-N 2.8Å; L888-E948 HydrophobicContact CD1-CG 3.89Å; L888-E948 HydrophobicContact CD2-CG 4.42Å; L888-L949 HydrophobicContact CB-CD2 3.94Å; L888-A952 HydrophobicContact CD1-CB 3.54Å
889	L	90.6	Very high	83.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.4	-38.4	-178.6	-70.2	171.6	0	0	0	113.6	I885 W903 L911 V917 V920 A924 L949	I885-L889 HydrophobicContact CD1-CD1 4.07Å; I885-L889 HydrophobicContact CD1-CG 4.01Å; I885-L889 HydrophobicContact CG1-CD1 3.82Å; I885-L889 HydrophobicContact CG1-CG 4.22Å; I885-L889 VanDerWaalsContact O-CB 3.3Å; I885-L889 WeakPolarHBondContact O-CB 3.43Å; I885-L889 WeakPolarHBondContact O-CG 3.07Å; I885-L889 PolarHBondContact O-N 3.28Å; L889-W903 HydrophobicContact CD2-CH2 4.36Å; L889-L911 HydrophobicContact CB-CD1 4.22Å; L889-L911 HydrophobicContact CD1-CD2 4.43Å; L889-V917 HydrophobicContact CD1-CG1 4.05Å; L889-V920 HydrophobicContact CB-CG1 4.21Å; L889-V920 HydrophobicContact CD1-CB 4.45Å; L889-V920 HydrophobicContact CD1-CG1 4.13Å; L889-V920 HydrophobicContact CD2-CG1 4.32Å; L889-V920 HydrophobicContact CG-CG1 4.46Å; L889-A924 HydrophobicContact CD2-CB 3.51Å; L889-L949 HydrophobicContact CD2-CD2 3.87Å; L889-L949 HydrophobicContact CG-CD2 4.28Å
890	S	89	Confident	83.4	Confident	14 Å²	14	50 Å²	50	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-41	176.7	51.6	0	0	0	0	112.5	R886 A887 L888 H893 V906	R886-S890 WeakPolarHBondContact O-CB 3.45Å; R886-S890 PolarHBondContact O-N 3.36Å; R886-S890 VanDerWaalsContact O-N 3.09Å; R886-S890 PolarHBondContact O-OG 3.3Å; A887-S890 PolarHBondContact O-OG 3.36Å; L888-S890 VanDerWaalsContact C-N 3.33Å; L888-S890 PolarHBondContact O-N 3.43Å; S890-H893 PolarHBondContact O-CE1 3.34Å; S890-H893 PolarHBondContact O-ND1 3.49Å; S890-V906 WeakPolarHBondContact CA-O 3.27Å; S890-V906 WeakPolarHBondContact CB-O 3.3Å
891	T	89.4	Confident	83.2	Confident	41 Å²	41	52.1 Å²	52.1	25%	0.252	28%	0.28	S	S	.	.	H	α-helix	trans	-91.3	-0.3	-179.4	62.1	0	0	0	0	115	W877 K881 A887 L888 H893 T894	W877-T891 PolarHBondContact NE1-O 2.96Å; W877-T891 PolarHBondContact NE1-OG1 2.7Å; W877-T891 VanDerWaalsContact NE1-OG1 3.08Å; K881-T891 PolarHBondContact NZ-OG1 3.32Å; K881-T891 VanDerWaalsContact NZ-OG1 3.09Å; A887-T891 PolarHBondContact O-N 3.13Å; A887-T891 VanDerWaalsContact O-N 3.14Å; A887-T891 PolarHBondContact O-OG1 3.41Å; L888-T891 CarbonylContact O-C 3.54Å; L888-T891 PolarHBondContact O-N 2.97Å; L888-T891 VanDerWaalsContact O-N 3.15Å; T891-H893 PolarHBondContact O-N 3.23Å; T891-T894 PolarHBondContact O-N 2.93Å; T891-T894 PolarHBondContact O-OG1 2.64Å; T891-T894 VanDerWaalsContact O-OG1 3.1Å
892	M	87.9	Confident	83	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-56.2	-26.6	-176.9	-164.3	-177.5	99.5	0	0	113.8	W877 L888 T894 V895 L896 W903 A924 V928 I945 L949	W877-M892 HydrophobicContact CH2-CG 4.48Å; W877-M892 HydrophobicContact CZ2-CB 3.98Å; W877-M892 HydrophobicContact CZ2-CG 4.1Å; L888-M892 WeakPolarHBondContact O-CB 3.37Å; L888-M892 PolarHBondContact O-N 2.8Å; M892-T894 PolarHBondContact O-N 2.75Å; M892-T894 VanDerWaalsContact O-N 3.14Å; M892-V895 WeakPolarHBondContact O-CG2 3.49Å; M892-V895 PolarHBondContact O-N 3.42Å; M892-L896 HydrophobicContact CE-CD1 3.92Å; M892-L896 HydrophobicContact CE-CD2 4.22Å; M892-L896 HydrophobicContact CE-CG 4.42Å; M892-W903 HydrophobicContact CB-CZ2 4.38Å; M892-W903 HydrophobicContact CE-CD2 3.41Å; M892-W903 VanDerWaalsContact CE-CD2 3.41Å; M892-W903 HydrophobicContact CE-CE3 3.69Å; M892-W903 HydrophobicContact CE-CG 3.8Å; M892-W903 HydrophobicContact CE-CH2 4.17Å; M892-W903 HydrophobicContact CE-CZ2 3.93Å; M892-W903 HydrophobicContact CE-CZ3 4.08Å; M892-W903 HydrophobicContact SD-CZ2 4.22Å; M892-A924 HydrophobicContact CE-CB 3.98Å; M892-A924 HydrophobicContact SD-CB 3.63Å; M892-V928 HydrophobicContact CE-CG1 4.45Å; M892-I945 HydrophobicContact CG-CG2 4.28Å; M892-I945 HydrophobicContact SD-CG2 4.49Å; M892-L949 HydrophobicContact SD-CD1 3.66Å
893	H	86.1	Confident	83.5	Confident	92 Å²	92	53 Å²	53	43%	0.426	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-65	-11.3	177.6	68.5	-90.9	0	0	0	114.4	S890 T891 P905	S890-H893 PolarHBondContact O-CE1 3.34Å; S890-H893 PolarHBondContact O-ND1 3.49Å; T891-H893 PolarHBondContact O-N 3.23Å; H893-P905 HydrophobicContact CB-CB 4.46Å; H893-P905 HydrophobicContact CB-CG 4.16Å
894	T	87.4	Confident	83.8	Confident	82 Å²	82	55.1 Å²	55.1	50%	0.503	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-92	-3.1	178.1	73	0	0	0	0	114.1	T891 M892	T891-T894 PolarHBondContact O-N 2.93Å; T891-T894 PolarHBondContact O-OG1 2.64Å; T891-T894 VanDerWaalsContact O-OG1 3.1Å; M892-T894 PolarHBondContact O-N 2.75Å; M892-T894 VanDerWaalsContact O-N 3.14Å
895	V	87.1	Confident	83.8	Confident	13 Å²	13	56 Å²	56	8%	0.079	30%	0.3	C	S	.	.	S	Bend	trans	-132.2	8.1	-175.8	-66.5	0	0	0	0	114.5	K873 I874 W877 M892 I945	K873-V895 WeakPolarHBondContact O-CG1 3.35Å; I874-V895 HydrophobicContact CG1-CB 4.03Å; I874-V895 HydrophobicContact CG1-CG1 4.38Å; W877-V895 HydrophobicContact CB-CG1 3.39Å; W877-V895 HydrophobicContact CD2-CB 4.43Å; W877-V895 HydrophobicContact CD2-CG1 4.03Å; W877-V895 HydrophobicContact CD2-CG2 3.6Å; W877-V895 HydrophobicContact CE3-CG2 3.97Å; W877-V895 HydrophobicContact CG-CB 4.31Å; W877-V895 HydrophobicContact CG-CG1 3.44Å; W877-V895 VanDerWaalsContact CG-CG1 3.44Å; W877-V895 HydrophobicContact CG-CG2 3.9Å; W877-V895 HydrophobicContact CH2-CG2 4.43Å; W877-V895 HydrophobicContact CZ2-CG2 4.07Å; W877-V895 HydrophobicContact CZ3-CG2 4.38Å; M892-V895 WeakPolarHBondContact O-CG2 3.49Å; M892-V895 PolarHBondContact O-N 3.42Å; V895-I945 HydrophobicContact CB-CD1 4.43Å; V895-I945 HydrophobicContact CG2-CD1 4.05Å; V895-I945 HydrophobicContact CG2-CG1 4.44Å; V895-I945 WeakPolarHBondContact O-CD1 3.47Å
896	L	85.9	Confident	83.6	Confident	29 Å²	29	56.9 Å²	56.9	15%	0.152	31%	0.306	C	S	.	.	S	Bend	trans	-79.9	149.2	167.1	-65.6	171.5	0	0	0	109.7	M892 E900 W903 V927 V928	M892-L896 HydrophobicContact CE-CD1 3.92Å; M892-L896 HydrophobicContact CE-CD2 4.22Å; M892-L896 HydrophobicContact CE-CG 4.42Å; L896-E900 HydrophobicContact CB-CB 4.17Å; L896-E900 HydrophobicContact CB-CG 4.32Å; L896-E900 HydrophobicContact CD1-CG 3.96Å; L896-W903 HydrophobicContact CD1-CB 3.45Å; L896-W903 VanDerWaalsContact CD1-CB 3.45Å; L896-W903 HydrophobicContact CD1-CG 3.67Å; L896-V927 HydrophobicContact CD2-CG1 4.48Å; L896-V928 HydrophobicContact CD2-CG1 3.61Å
897	W	85.1	Confident	83.5	Confident	24 Å²	24	57.3 Å²	57.3	9%	0.091	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-63	153.8	176.1	51.3	87.9	0	0	0	111.8	G899 E900 V928 Y938 A942	W897-G899 PolarHBondContact O-N 2.89Å; W897-E900 HydrophobicContact CZ2-CG 4.3Å; W897-E900 VanDerWaalsContact CZ2-OE2 3.24Å; W897-E900 WeakPolarHBondContact CZ2-OE2 3.48Å; W897-E900 PolarHBondContact NE1-OE2 3.12Å; W897-E900 PolarHBondContact O-N 3.45Å; W897-V928 HydrophobicContact CH2-CG1 4.26Å; W897-V928 HydrophobicContact CZ3-CG1 4.39Å; W897-Y938 HydrophobicContact CB-CD1 4.21Å; W897-Y938 HydrophobicContact CB-CG 4.28Å; W897-Y938 AromaticContact CD1-CD1 3.88Å; W897-Y938 AromaticContact CD1-CE1 3.86Å; W897-Y938 AromaticContact CD2-CD1 3.96Å; W897-Y938 HydrophobicContact CD2-CD1 3.96Å; W897-Y938 AromaticContact CD2-CD2 3.47Å; W897-Y938 HydrophobicContact CD2-CD2 3.47Å; W897-Y938 VanDerWaalsContact CD2-CD2 3.47Å; W897-Y938 HydrophobicContact CD2-CE1 4.39Å; W897-Y938 AromaticContact CD2-CE2 3.92Å; W897-Y938 HydrophobicContact CD2-CE2 3.92Å; W897-Y938 AromaticContact CD2-CG 3.49Å; W897-Y938 HydrophobicContact CD2-CG 3.49Å; W897-Y938 VanDerWaalsContact CD2-CG 3.49Å; W897-Y938 AromaticContact CE2-CD2 3.49Å; W897-Y938 VanDerWaalsContact CE2-CD2 3.49Å; W897-Y938 AromaticContact CE2-CE2 3.42Å; W897-Y938 VanDerWaalsContact CE2-CE2 3.42Å; W897-Y938 AromaticContact CE2-CG 3.92Å; W897-Y938 AromaticContact CE2-CZ 3.82Å; W897-Y938 AromaticContact CE3-CD2 3.58Å; W897-Y938 HydrophobicContact CE3-CD2 3.58Å; W897-Y938 HydrophobicContact CE3-CE2 4.36Å; W897-Y938 AromaticContact CE3-CG 3.73Å; W897-Y938 HydrophobicContact CE3-CG 3.73Å; W897-Y938 AromaticContact CG-CD1 3.73Å; W897-Y938 HydrophobicContact CG-CD1 3.73Å; W897-Y938 HydrophobicContact CG-CD2 4.15Å; W897-Y938 HydrophobicContact CG-CE1 4.18Å; W897-Y938 AromaticContact CG-CG 3.73Å; W897-Y938 HydrophobicContact CG-CG 3.73Å; W897-Y938 AromaticContact CH2-CD2 3.76Å; W897-Y938 HydrophobicContact CH2-CD2 3.76Å; W897-Y938 AromaticContact CH2-CE2 3.96Å; W897-Y938 HydrophobicContact CH2-CE2 3.96Å; W897-Y938 AromaticContact CZ2-CD2 3.65Å; W897-Y938 HydrophobicContact CZ2-CD2 3.65Å; W897-Y938 AromaticContact CZ2-CE2 3.46Å; W897-Y938 HydrophobicContact CZ2-CE2 3.46Å; W897-Y938 VanDerWaalsContact CZ2-CE2 3.46Å; W897-Y938 AromaticContact CZ3-CD2 3.72Å; W897-Y938 HydrophobicContact CZ3-CD2 3.72Å; W897-Y938 HydrophobicContact CZ3-CE2 4.38Å; W897-Y938 HydrophobicContact CZ3-CG 4.33Å; W897-Y938 AromaticContact NE1-CE1 3.87Å; W897-Y938 AromaticContact NE1-CE2 3.79Å; W897-Y938 AromaticContact NE1-CZ 3.66Å; W897-A942 HydrophobicContact CH2-CB 4.17Å; W897-A942 HydrophobicContact CZ3-CB 3.98Å
898	E	71	Confident	83.3	Confident	181 Å²	181	60.5 Å²	60.5	85%	0.846	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	135.2	-178.9	-61.5	-171	176.8	0	0	111.3
899	G	63.6	Low	82.8	Confident	69 Å²	69	64.2 Å²	64.2	71%	0.711	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	-2.3	-176.3	0	0	0	0	0	116.3	W897 T901	W897-G899 PolarHBondContact O-N 2.89Å; G899-T901 PolarHBondContact O-N 3.01Å
900	E	73.6	Confident	82.3	Confident	25 Å²	25	68.4 Å²	68.4	12%	0.117	38%	0.383	C	S	.	.			trans	-71.7	92	178	-175.5	47.3	-95.7	0	0	113.2	L896 W897 R902 V927	L896-E900 HydrophobicContact CB-CB 4.17Å; L896-E900 HydrophobicContact CB-CG 4.32Å; L896-E900 HydrophobicContact CD1-CG 3.96Å; W897-E900 HydrophobicContact CZ2-CG 4.3Å; W897-E900 VanDerWaalsContact CZ2-OE2 3.24Å; W897-E900 WeakPolarHBondContact CZ2-OE2 3.48Å; W897-E900 PolarHBondContact NE1-OE2 3.12Å; W897-E900 PolarHBondContact O-N 3.45Å; E900-R902 WeakPolarHBondContact OE1-CA 3.35Å; E900-R902 WeakPolarHBondContact OE1-CB 3.4Å; E900-R902 VanDerWaalsContact OE1-CG 3.3Å; E900-R902 WeakPolarHBondContact OE1-CG 3.16Å; E900-R902 IonicContact OE1-CZ 2.59Å; E900-R902 PolarHBondContact OE1-N 3.11Å; E900-R902 IonicContact OE1-NE 3.68Å; E900-R902 PolarHBondContact OE1-NE 3.23Å; E900-R902 IonicContact OE1-NH2 3.67Å; E900-R902 IonicContact OE2-CZ 2.78Å; E900-R902 VanDerWaalsContact OE2-CZ 3.3Å; E900-R902 IonicContact OE2-NE 2.73Å; E900-R902 PolarHBondContact OE2-NE 3.34Å; E900-R902 VanDerWaalsContact OE2-NE 3.15Å; E900-R902 IonicContact OE2-NH2 2.65Å; E900-R902 PolarHBondContact OE2-NH2 2.83Å; E900-V927 HydrophobicContact CG-CG1 3.9Å
901	T	70.2	Confident	82.2	Confident	123 Å²	123	67.7 Å²	67.7	76%	0.755	38%	0.378	S	S	*	.			trans	-89.5	-6.6	-177.3	51.7	0	0	0	0	115	G899	G899-T901 PolarHBondContact O-N 3.01Å
902	R	78.4	Confident	81.9	Confident	157 Å²	157	67.5 Å²	67.5	59%	0.592	38%	0.377	S	S	*	.	S	Bend	trans	-81.8	-21.9	-177	-56.8	167.7	-78.6	-149.1	6	112.1	E900 V927	E900-R902 WeakPolarHBondContact OE1-CA 3.35Å; E900-R902 WeakPolarHBondContact OE1-CB 3.4Å; E900-R902 VanDerWaalsContact OE1-CG 3.3Å; E900-R902 WeakPolarHBondContact OE1-CG 3.16Å; E900-R902 IonicContact OE1-CZ 2.59Å; E900-R902 PolarHBondContact OE1-N 3.11Å; E900-R902 IonicContact OE1-NE 3.68Å; E900-R902 PolarHBondContact OE1-NE 3.23Å; E900-R902 IonicContact OE1-NH2 3.67Å; E900-R902 IonicContact OE2-CZ 2.78Å; E900-R902 VanDerWaalsContact OE2-CZ 3.3Å; E900-R902 IonicContact OE2-NE 2.73Å; E900-R902 PolarHBondContact OE2-NE 3.34Å; E900-R902 VanDerWaalsContact OE2-NE 3.15Å; E900-R902 IonicContact OE2-NH2 2.65Å; E900-R902 PolarHBondContact OE2-NH2 2.83Å; R902-V927 HydrophobicContact CB-CG2 4.07Å
903	W	86.3	Confident	81.8	Confident	19 Å²	19	70 Å²	70	7%	0.072	39%	0.392	C	S	.	.			trans	-85.9	140.4	169.2	-167.5	-119.7	0	0	0	111.3	L889 M892 L896 V906 V920 K923 A924 V927	L889-W903 HydrophobicContact CD2-CH2 4.36Å; M892-W903 HydrophobicContact CB-CZ2 4.38Å; M892-W903 HydrophobicContact CE-CD2 3.41Å; M892-W903 VanDerWaalsContact CE-CD2 3.41Å; M892-W903 HydrophobicContact CE-CE3 3.69Å; M892-W903 HydrophobicContact CE-CG 3.8Å; M892-W903 HydrophobicContact CE-CH2 4.17Å; M892-W903 HydrophobicContact CE-CZ2 3.93Å; M892-W903 HydrophobicContact CE-CZ3 4.08Å; M892-W903 HydrophobicContact SD-CZ2 4.22Å; L896-W903 HydrophobicContact CD1-CB 3.45Å; L896-W903 VanDerWaalsContact CD1-CB 3.45Å; L896-W903 HydrophobicContact CD1-CG 3.67Å; W903-V906 HydrophobicContact CH2-CG2 4.3Å; W903-V906 HydrophobicContact CZ2-CG2 3.95Å; W903-V920 HydrophobicContact CH2-CG1 3.64Å; W903-V920 HydrophobicContact CZ2-CG1 4.28Å; W903-K923 HydrophobicContact CZ3-CB 3.91Å; W903-A924 HydrophobicContact CH2-CB 3.77Å; W903-A924 HydrophobicContact CZ3-CB 3.8Å; W903-V927 HydrophobicContact CE3-CG2 4.34Å
904	K	82.8	Confident	81.7	Confident	164 Å²	164	66.2 Å²	66.2	71%	0.713	38%	0.376	S	S	*	.			trans	-117.1	134.1	169.2	-64.3	-167.8	176.6	-168.4	0	107.6	V906	K904-V906 WeakPolarHBondContact O-CG2 3.49Å; K904-V906 PolarHBondContact O-N 3.11Å
905	P	85.3	Confident	81.6	Confident	97 Å²	97	68.2 Å²	68.2	63%	0.63	38%	0.379	S	S	*	.			trans	-52.8	137.9	174.3	-26.4	35	0	0	0	111.3	H893	H893-P905 HydrophobicContact CB-CB 4.46Å; H893-P905 HydrophobicContact CB-CG 4.16Å
906	V	88.2	Confident	81.6	Confident	24 Å²	24	70.9 Å²	70.9	15%	0.145	39%	0.391	C	S	.	.			trans	-120	125.8	-175.7	-176.7	0	0	0	0	108.8	S890 W903 K904 D910 L911 V920	S890-V906 WeakPolarHBondContact CA-O 3.27Å; S890-V906 WeakPolarHBondContact CB-O 3.3Å; W903-V906 HydrophobicContact CH2-CG2 4.3Å; W903-V906 HydrophobicContact CZ2-CG2 3.95Å; K904-V906 WeakPolarHBondContact O-CG2 3.49Å; K904-V906 PolarHBondContact O-N 3.11Å; V906-D910 HydrophobicContact CG1-CB 3.63Å; V906-L911 HydrophobicContact CG1-CD1 4.14Å; V906-L911 HydrophobicContact CG1-CD2 4.17Å; V906-L911 HydrophobicContact CG1-CG 3.91Å; V906-V920 HydrophobicContact CB-CG1 4.39Å; V906-V920 HydrophobicContact CG1-CG1 4.14Å; V906-V920 HydrophobicContact CG1-CG2 4.07Å; V906-V920 HydrophobicContact CG2-CG1 3.9Å
907	G	87.3	Confident	81.7	Confident	32 Å²	32	69.5 Å²	69.5	33%	0.33	38%	0.384	S	S	.	.			trans	-75.3	156.4	177.9	0	0	0	0	0	111.8	A909 D910	G907-A909 PolarHBondContact O-N 3.17Å; G907-D910 PolarHBondContact N-OD2 2.96Å; G907-D910 WeakPolarHBondContact O-CB 3.14Å; G907-D910 PolarHBondContact O-N 3.05Å
908	M	83	Confident	82	Confident	84 Å²	84	71.4 Å²	71.4	41%	0.414	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-60.9	-23.8	169.2	-75.4	-68.1	-72.4	0	0	112.5	R886 D910 L911 L964	R886-M908 HydrophobicContact CB-CE 4.09Å; R886-M908 HydrophobicContact CB-SD 4.07Å; M908-D910 VanDerWaalsContact C-N 3.29Å; M908-D910 PolarHBondContact O-N 3.3Å; M908-L911 PolarHBondContact O-N 3.48Å; M908-L911 HydrophobicContact SD-CD1 4.4Å; M908-L964 HydrophobicContact CE-CD1 4.05Å
909	A	80.9	Confident	82.9	Confident	79 Å²	79	69.7 Å²	69.7	65%	0.653	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-65.7	-28.1	171.3	0	0	0	0	0	113.4	G907 L911 V912	G907-A909 PolarHBondContact O-N 3.17Å; A909-L911 VanDerWaalsContact C-N 3.26Å; A909-L911 PolarHBondContact O-N 3.23Å; A909-V912 WeakPolarHBondContact O-CG2 3.45Å
910	D	80.8	Confident	84.2	Confident	87 Å²	87	67.3 Å²	67.3	47%	0.465	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-86.3	4.8	177.1	-55.5	-65	0	0	0	112.7	V906 G907 M908 Q916	V906-D910 HydrophobicContact CG1-CB 3.63Å; G907-D910 PolarHBondContact N-OD2 2.96Å; G907-D910 WeakPolarHBondContact O-CB 3.14Å; G907-D910 PolarHBondContact O-N 3.05Å; M908-D910 VanDerWaalsContact C-N 3.29Å; M908-D910 PolarHBondContact O-N 3.3Å; D910-Q916 VanDerWaalsContact O-CB 3.32Å; D910-Q916 WeakPolarHBondContact O-CB 3.44Å
911	L	86.4	Confident	85.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-125.7	17.7	-174.2	-66.6	172.4	0	0	0	112.4	R886 L889 V906 M908 A909 V917 V920	R886-L911 HydrophobicContact CG-CB 4.36Å; R886-L911 PolarHBondContact NE-O 2.98Å; L889-L911 HydrophobicContact CB-CD1 4.22Å; L889-L911 HydrophobicContact CD1-CD2 4.43Å; V906-L911 HydrophobicContact CG1-CD1 4.14Å; V906-L911 HydrophobicContact CG1-CD2 4.17Å; V906-L911 HydrophobicContact CG1-CG 3.91Å; M908-L911 PolarHBondContact O-N 3.48Å; M908-L911 HydrophobicContact SD-CD1 4.4Å; A909-L911 VanDerWaalsContact C-N 3.26Å; A909-L911 PolarHBondContact O-N 3.23Å; L911-V917 HydrophobicContact CB-CG2 4.27Å; L911-V917 HydrophobicContact CD2-CG2 4.23Å; L911-V917 WeakPolarHBondContact O-CG2 3.3Å; L911-V920 HydrophobicContact CD2-CB 3.84Å; L911-V920 HydrophobicContact CD2-CG1 4.03Å; L911-V920 HydrophobicContact CD2-CG2 3.89Å
912	V	82.4	Confident	86.1	Confident	37 Å²	37	69.3 Å²	69.3	22%	0.224	35%	0.347	C	S	.	.	S	Bend	trans	-68.6	-51.2	-174	175.5	0	0	0	0	111.6	R886 A909 Q916 L964 Y965	R886-V912 PolarHBondContact NH2-O 2.88Å; A909-V912 WeakPolarHBondContact O-CG2 3.45Å; V912-Q916 VanDerWaalsContact N-OE1 3.07Å; V912-L964 HydrophobicContact CG1-CB 4.28Å; V912-L964 PolarHBondContact O-N 3.13Å; V912-L964 VanDerWaalsContact O-N 3.11Å; V912-Y965 HydrophobicContact CG1-CD2 3.89Å; V912-Y965 HydrophobicContact CG1-CE2 4.01Å; V912-Y965 HydrophobicContact CG2-CE2 4.46Å
913	T	85.8	Confident	86.6	Confident	51 Å²	51	67.8 Å²	67.8	31%	0.313	34%	0.344	S	S	.	.	S	Bend	trans	-90.1	152.6	-179.9	92.4	0	0	0	0	112.1	E915 Q916 V917	T913-E915 VanDerWaalsContact C-N 3.27Å; T913-E915 WeakPolarHBondContact CB-OE2 3.45Å; T913-E915 PolarHBondContact O-N 2.91Å; T913-E915 PolarHBondContact OG1-OE2 3.1Å; T913-Q916 WeakPolarHBondContact O-CB 3.38Å; T913-Q916 PolarHBondContact O-N 3.18Å; T913-Q916 WeakPolarHBondContact OG1-CG 3.26Å; T913-Q916 PolarHBondContact OG1-N 3.29Å; T913-V917 WeakPolarHBondContact O-CG2 3.29Å; T913-V917 PolarHBondContact O-N 3.34Å; T913-V917 VanDerWaalsContact O-N 3.17Å
914	P	83.9	Confident	86.8	Confident	13 Å²	13	66.9 Å²	66.9	8%	0.084	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-32.2	-178.8	-21.3	34.2	0	0	0	113.8	Q916 V917 K918 F956 Q961	P914-Q916 VanDerWaalsContact C-N 3.33Å; P914-V917 PolarHBondContact O-N 2.86Å; P914-K918 WeakPolarHBondContact O-CB 3.23Å; P914-K918 PolarHBondContact O-N 2.81Å; P914-F956 HydrophobicContact CB-CE1 4.32Å; P914-F956 HydrophobicContact CB-CZ 4.02Å; P914-Q961 HydrophobicContact CB-CB 3.97Å; P914-Q961 HydrophobicContact CG-CB 4.37Å; P914-Q961 WeakPolarHBondContact CG-O 3.41Å
915	E	84.9	Confident	87.2	Confident	124 Å²	124	60.4 Å²	60.4	58%	0.579	32%	0.315	S	S	*	.	H	α-helix	trans	-67.2	-37.2	178.5	-53.5	67.8	-142	0	0	110.7	T913 K918 K919	T913-E915 VanDerWaalsContact C-N 3.27Å; T913-E915 WeakPolarHBondContact CB-OE2 3.45Å; T913-E915 PolarHBondContact O-N 2.91Å; T913-E915 PolarHBondContact OG1-OE2 3.1Å; E915-K918 PolarHBondContact O-N 3.35Å; E915-K919 VanDerWaalsContact O-CB 3.25Å; E915-K919 WeakPolarHBondContact O-CB 3.43Å; E915-K919 PolarHBondContact O-N 2.91Å
916	Q	86.9	Confident	87.3	Confident	70 Å²	70	60.6 Å²	60.6	33%	0.327	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-48.6	172.4	-65.4	173.1	-40.8	0	0	110.8	D910 V912 T913 P914 K918 K919 V920	D910-Q916 VanDerWaalsContact O-CB 3.32Å; D910-Q916 WeakPolarHBondContact O-CB 3.44Å; V912-Q916 VanDerWaalsContact N-OE1 3.07Å; T913-Q916 WeakPolarHBondContact O-CB 3.38Å; T913-Q916 PolarHBondContact O-N 3.18Å; T913-Q916 WeakPolarHBondContact OG1-CG 3.26Å; T913-Q916 PolarHBondContact OG1-N 3.29Å; P914-Q916 VanDerWaalsContact C-N 3.33Å; Q916-K918 VanDerWaalsContact C-N 3.31Å; Q916-K918 PolarHBondContact O-N 3.21Å; Q916-K919 PolarHBondContact O-N 3.06Å; Q916-K919 VanDerWaalsContact O-N 3.14Å; Q916-V920 WeakPolarHBondContact O-CG2 3.34Å; Q916-V920 PolarHBondContact O-N 2.97Å
917	V	88.9	Confident	87.2	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-45.8	175.2	-173.5	0	0	0	0	110.5	I885 R886 L889 L911 T913 P914 K919 V920 Y921 W953 F956	I885-V917 HydrophobicContact CG1-CG1 4.29Å; I885-V917 HydrophobicContact CG2-CG1 3.92Å; R886-V917 HydrophobicContact CG-CG2 3.93Å; L889-V917 HydrophobicContact CD1-CG1 4.05Å; L911-V917 HydrophobicContact CB-CG2 4.27Å; L911-V917 HydrophobicContact CD2-CG2 4.23Å; L911-V917 WeakPolarHBondContact O-CG2 3.3Å; T913-V917 WeakPolarHBondContact O-CG2 3.29Å; T913-V917 PolarHBondContact O-N 3.34Å; T913-V917 VanDerWaalsContact O-N 3.17Å; P914-V917 PolarHBondContact O-N 2.86Å; V917-K919 VanDerWaalsContact C-N 3.34Å; V917-K919 PolarHBondContact O-N 3.21Å; V917-V920 PolarHBondContact O-N 3.29Å; V917-Y921 WeakPolarHBondContact O-CB 3.15Å; V917-Y921 PolarHBondContact O-N 3.27Å; V917-W953 HydrophobicContact CG1-CZ3 4.04Å; V917-F956 HydrophobicContact CB-CE1 4.18Å; V917-F956 HydrophobicContact CB-CZ 4.48Å; V917-F956 HydrophobicContact CG1-CD1 4.39Å; V917-F956 HydrophobicContact CG1-CE1 4.11Å; V917-F956 HydrophobicContact CG2-CZ 4.48Å
918	K	90.6	Very high	87.3	Confident	63 Å²	63	58.5 Å²	58.5	27%	0.274	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-38.1	177.8	-160.5	152.3	-168.1	152.9	0	112.7	P914 E915 Q916 R922 W953 E957	P914-K918 WeakPolarHBondContact O-CB 3.23Å; P914-K918 PolarHBondContact O-N 2.81Å; E915-K918 PolarHBondContact O-N 3.35Å; Q916-K918 VanDerWaalsContact C-N 3.31Å; Q916-K918 PolarHBondContact O-N 3.21Å; K918-R922 WeakPolarHBondContact O-CB 3.38Å; K918-R922 VanDerWaalsContact O-CG 3.3Å; K918-R922 WeakPolarHBondContact O-CG 3.19Å; K918-R922 PolarHBondContact O-N 3.28Å; K918-W953 HydrophobicContact CB-CH2 3.54Å; K918-W953 HydrophobicContact CB-CZ2 4.4Å; K918-W953 HydrophobicContact CB-CZ3 4.12Å; K918-W953 HydrophobicContact CD-CH2 3.66Å; K918-W953 HydrophobicContact CD-CZ2 3.77Å; K918-W953 HydrophobicContact CG-CH2 3.45Å; K918-W953 VanDerWaalsContact CG-CH2 3.45Å; K918-W953 HydrophobicContact CG-CZ2 3.81Å; K918-W953 HydrophobicContact CG-CZ3 4.35Å; K918-E957 IonicContact NZ-OE1 2.68Å; K918-E957 PolarHBondContact NZ-OE1 3.5Å
919	K	90.4	Very high	87.5	Confident	146 Å²	146	56.9 Å²	56.9	64%	0.635	28%	0.282	S	S	*	.	H	α-helix	trans	-71.4	-36	177.5	-174.4	176.5	-177.2	177.5	0	112.5	E915 Q916 V917	E915-K919 VanDerWaalsContact O-CB 3.25Å; E915-K919 WeakPolarHBondContact O-CB 3.43Å; E915-K919 PolarHBondContact O-N 2.91Å; Q916-K919 PolarHBondContact O-N 3.06Å; Q916-K919 VanDerWaalsContact O-N 3.14Å; V917-K919 VanDerWaalsContact C-N 3.34Å; V917-K919 PolarHBondContact O-N 3.21Å
920	V	91.5	Very high	87.4	Confident	18 Å²	18	54.2 Å²	54.2	11%	0.109	26%	0.258	C	S	.	.	H	α-helix	trans	-78	-44	177.3	174.7	0	0	0	0	111.1	L889 W903 V906 L911 Q916 V917 R922 K923 A924	L889-V920 HydrophobicContact CB-CG1 4.21Å; L889-V920 HydrophobicContact CD1-CB 4.45Å; L889-V920 HydrophobicContact CD1-CG1 4.13Å; L889-V920 HydrophobicContact CD2-CG1 4.32Å; L889-V920 HydrophobicContact CG-CG1 4.46Å; W903-V920 HydrophobicContact CH2-CG1 3.64Å; W903-V920 HydrophobicContact CZ2-CG1 4.28Å; V906-V920 HydrophobicContact CB-CG1 4.39Å; V906-V920 HydrophobicContact CG1-CG1 4.14Å; V906-V920 HydrophobicContact CG1-CG2 4.07Å; V906-V920 HydrophobicContact CG2-CG1 3.9Å; L911-V920 HydrophobicContact CD2-CB 3.84Å; L911-V920 HydrophobicContact CD2-CG1 4.03Å; L911-V920 HydrophobicContact CD2-CG2 3.89Å; Q916-V920 WeakPolarHBondContact O-CG2 3.34Å; Q916-V920 PolarHBondContact O-N 2.97Å; V917-V920 PolarHBondContact O-N 3.29Å; V920-R922 PolarHBondContact O-N 2.65Å; V920-K923 WeakPolarHBondContact O-CA 3.38Å; V920-K923 WeakPolarHBondContact O-CB 3.29Å; V920-K923 PolarHBondContact O-N 3.04Å; V920-A924 PolarHBondContact O-N 3.04Å
921	Y	92.4	Very high	87.4	Confident	27 Å²	27	55.7 Å²	55.7	11%	0.106	27%	0.267	C	S	.	.	H	α-helix	trans	-53.5	-49.6	174	170.7	-114.1	0	0	0	112.3	I885 V917 K923 A924 V925 L949 N950 W953	I885-Y921 HydrophobicContact CD1-CD2 4.08Å; V917-Y921 WeakPolarHBondContact O-CB 3.15Å; V917-Y921 PolarHBondContact O-N 3.27Å; Y921-K923 PolarHBondContact O-N 2.92Å; Y921-K923 VanDerWaalsContact O-N 3.16Å; Y921-A924 WeakPolarHBondContact O-CB 3.4Å; Y921-A924 PolarHBondContact O-N 2.98Å; Y921-V925 HydrophobicContact CD1-CG2 4.45Å; Y921-V925 HydrophobicContact CD2-CG2 3.9Å; Y921-V925 HydrophobicContact CE1-CG2 4.09Å; Y921-V925 HydrophobicContact CE2-CG2 3.48Å; Y921-V925 VanDerWaalsContact CE2-CG2 3.48Å; Y921-V925 HydrophobicContact CG-CG2 4.38Å; Y921-V925 WeakPolarHBondContact O-CG2 3.27Å; Y921-V925 PolarHBondContact O-N 3.17Å; Y921-L949 HydrophobicContact CE2-CB 4.35Å; Y921-L949 WeakPolarHBondContact CE2-O 3.48Å; Y921-N950 PolarHBondContact OH-OD1 2.73Å; Y921-W953 HydrophobicContact CD1-CB 4.44Å; Y921-W953 AromaticContact CD1-CD2 3.34Å; Y921-W953 HydrophobicContact CD1-CD2 3.34Å; Y921-W953 AromaticContact CD1-CE2 3.8Å; Y921-W953 AromaticContact CD1-CE3 3.48Å; Y921-W953 HydrophobicContact CD1-CE3 3.48Å; Y921-W953 VanDerWaalsContact CD1-CE3 3.48Å; Y921-W953 AromaticContact CD1-CG 3.75Å; Y921-W953 HydrophobicContact CD1-CG 3.75Å; Y921-W953 HydrophobicContact CD1-CZ2 4.38Å; Y921-W953 HydrophobicContact CD1-CZ3 4.11Å; Y921-W953 HydrophobicContact CD2-CB 3.99Å; Y921-W953 HydrophobicContact CD2-CD2 4.24Å; Y921-W953 HydrophobicContact CD2-CE3 4.11Å; Y921-W953 HydrophobicContact CD2-CG 4.18Å; Y921-W953 HydrophobicContact CE1-CB 3.95Å; Y921-W953 AromaticContact CE1-CD1 3.49Å; Y921-W953 VanDerWaalsContact CE1-CD1 3.49Å; Y921-W953 AromaticContact CE1-CD2 3.37Å; Y921-W953 HydrophobicContact CE1-CD2 3.37Å; Y921-W953 AromaticContact CE1-CE2 3.73Å; Y921-W953 HydrophobicContact CE1-CE3 4.01Å; Y921-W953 AromaticContact CE1-CG 3.27Å; Y921-W953 HydrophobicContact CE1-CG 3.27Å; Y921-W953 AromaticContact CE1-NE1 3.74Å; Y921-W953 HydrophobicContact CE2-CB 3.43Å; Y921-W953 VanDerWaalsContact CE2-CB 3.43Å; Y921-W953 HydrophobicContact CE2-CD2 4.26Å; Y921-W953 AromaticContact CE2-CG 3.75Å; Y921-W953 HydrophobicContact CE2-CG 3.75Å; Y921-W953 HydrophobicContact CG-CB 4.44Å; Y921-W953 AromaticContact CG-CD2 3.79Å; Y921-W953 HydrophobicContact CG-CD2 3.79Å; Y921-W953 AromaticContact CG-CE3 3.52Å; Y921-W953 HydrophobicContact CG-CE3 3.52Å; Y921-W953 HydrophobicContact CG-CG 4.16Å; Y921-W953 HydrophobicContact CG-CZ3 4.23Å; Y921-W953 AromaticContact CZ-CD1 3.6Å; Y921-W953 AromaticContact CZ-CD2 3.83Å; Y921-W953 AromaticContact CZ-CG 3.24Å
922	R	90.2	Very high	87	Confident	163 Å²	163	61.4 Å²	61.4	62%	0.615	29%	0.291	S	S	*	.	H	α-helix	trans	-57.3	-30.4	175.7	-77.8	174.6	170.2	-170.6	-4.7	113.5	K918 V920 L926	K918-R922 WeakPolarHBondContact O-CB 3.38Å; K918-R922 VanDerWaalsContact O-CG 3.3Å; K918-R922 WeakPolarHBondContact O-CG 3.19Å; K918-R922 PolarHBondContact O-N 3.28Å; V920-R922 PolarHBondContact O-N 2.65Å; R922-L926 WeakPolarHBondContact O-CD1 3.35Å; R922-L926 VanDerWaalsContact O-CG 3.27Å; R922-L926 WeakPolarHBondContact O-CG 3.32Å; R922-L926 PolarHBondContact O-N 3.2Å
923	K	89.3	Confident	86.7	Confident	125 Å²	125	59.7 Å²	59.7	54%	0.543	28%	0.281	S	S	.	.	H	α-helix	trans	-74.9	-40.1	173.1	-69	178.2	175.1	-171.4	0	111.9	W903 V920 Y921 L926 V927	W903-K923 HydrophobicContact CZ3-CB 3.91Å; V920-K923 WeakPolarHBondContact O-CA 3.38Å; V920-K923 WeakPolarHBondContact O-CB 3.29Å; V920-K923 PolarHBondContact O-N 3.04Å; Y921-K923 PolarHBondContact O-N 2.92Å; Y921-K923 VanDerWaalsContact O-N 3.16Å; K923-L926 PolarHBondContact O-N 2.6Å; K923-V927 PolarHBondContact O-N 3.21Å
924	A	91	Very high	86.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-50.1	178.6	0	0	0	0	0	111	L889 M892 W903 V920 Y921 L926 V927 V928 L949	L889-A924 HydrophobicContact CD2-CB 3.51Å; M892-A924 HydrophobicContact CE-CB 3.98Å; M892-A924 HydrophobicContact SD-CB 3.63Å; W903-A924 HydrophobicContact CH2-CB 3.77Å; W903-A924 HydrophobicContact CZ3-CB 3.8Å; V920-A924 PolarHBondContact O-N 3.04Å; Y921-A924 WeakPolarHBondContact O-CB 3.4Å; Y921-A924 PolarHBondContact O-N 2.98Å; A924-L926 PolarHBondContact O-N 3.1Å; A924-L926 VanDerWaalsContact O-N 3.16Å; A924-V927 PolarHBondContact O-N 3.01Å; A924-V928 WeakPolarHBondContact O-CG2 3.41Å; A924-V928 PolarHBondContact O-N 3.21Å; A924-L949 HydrophobicContact CB-CD1 4.02Å
925	V	90.6	Very high	85.5	Confident	28 Å²	28	63.9 Å²	63.9	17%	0.17	32%	0.32	C	S	.	.	H	α-helix	trans	-53.2	-34.1	173.6	171.6	0	0	0	0	112.2	Y921 H929 F946	Y921-V925 HydrophobicContact CD1-CG2 4.45Å; Y921-V925 HydrophobicContact CD2-CG2 3.9Å; Y921-V925 HydrophobicContact CE1-CG2 4.09Å; Y921-V925 HydrophobicContact CE2-CG2 3.48Å; Y921-V925 VanDerWaalsContact CE2-CG2 3.48Å; Y921-V925 HydrophobicContact CG-CG2 4.38Å; Y921-V925 WeakPolarHBondContact O-CG2 3.27Å; Y921-V925 PolarHBondContact O-N 3.17Å; V925-H929 WeakPolarHBondContact O-CB 3.42Å; V925-H929 PolarHBondContact O-N 3.4Å; V925-F946 HydrophobicContact CG1-CE2 3.91Å
926	L	87.7	Confident	85.3	Confident	102 Å²	102	62 Å²	62	53%	0.534	31%	0.311	S	S	.	.	H	α-helix	trans	-79.4	-14.8	176.5	-76.5	170.9	0	0	0	114.9	R922 K923 A924 K932	R922-L926 WeakPolarHBondContact O-CD1 3.35Å; R922-L926 VanDerWaalsContact O-CG 3.27Å; R922-L926 WeakPolarHBondContact O-CG 3.32Å; R922-L926 PolarHBondContact O-N 3.2Å; K923-L926 PolarHBondContact O-N 2.6Å; A924-L926 PolarHBondContact O-N 3.1Å; A924-L926 VanDerWaalsContact O-N 3.16Å; L926-K932 WeakPolarHBondContact O-CD 3.22Å; L926-K932 PolarHBondContact O-NZ 3.31Å
927	V	86.6	Confident	84.9	Confident	12 Å²	12	64.2 Å²	64.2	7%	0.073	33%	0.332	C	S	.	.	H	α-helix	trans	-92.1	-50	174.6	173.8	0	0	0	0	110.5	L896 E900 R902 W903 K923 A924 H929	L896-V927 HydrophobicContact CD2-CG1 4.48Å; E900-V927 HydrophobicContact CG-CG1 3.9Å; R902-V927 HydrophobicContact CB-CG2 4.07Å; W903-V927 HydrophobicContact CE3-CG2 4.34Å; K923-V927 PolarHBondContact O-N 3.21Å; A924-V927 PolarHBondContact O-N 3.01Å; V927-H929 VanDerWaalsContact C-N 3.33Å; V927-H929 PolarHBondContact O-N 3.36Å
928	V	88.9	Confident	84.4	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.339	C	S	.	.	S	Bend	trans	-91.6	19.3	-177.3	-58.6	0	0	0	0	114.1	M892 L896 W897 A924 A942 I945 F946 L949	M892-V928 HydrophobicContact CE-CG1 4.45Å; L896-V928 HydrophobicContact CD2-CG1 3.61Å; W897-V928 HydrophobicContact CH2-CG1 4.26Å; W897-V928 HydrophobicContact CZ3-CG1 4.39Å; A924-V928 WeakPolarHBondContact O-CG2 3.41Å; A924-V928 PolarHBondContact O-N 3.21Å; V928-A942 HydrophobicContact CB-CB 4.45Å; V928-I945 HydrophobicContact CG1-CB 4.42Å; V928-I945 HydrophobicContact CG1-CG2 4.08Å; V928-I945 HydrophobicContact CG2-CG2 4.23Å; V928-F946 HydrophobicContact CG2-CB 3.97Å; V928-F946 HydrophobicContact CG2-CD2 4.3Å; V928-L949 HydrophobicContact CG2-CD1 4.13Å
929	H	86.8	Confident	84	Confident	49 Å²	49	65.5 Å²	65.5	23%	0.227	34%	0.337	C	S	.	.			trans	-62.1	129.9	-179.2	-154.3	-85.2	0	0	0	111.4	V925 V927 D931 K932 A933 F946	V925-H929 WeakPolarHBondContact O-CB 3.42Å; V925-H929 PolarHBondContact O-N 3.4Å; V927-H929 VanDerWaalsContact C-N 3.33Å; V927-H929 PolarHBondContact O-N 3.36Å; H929-D931 VanDerWaalsContact C-N 3.3Å; H929-D931 IonicContact CE1-OD1 3.62Å; H929-D931 PolarHBondContact CE1-OD1 3.4Å; H929-D931 IonicContact CE1-OD2 3.98Å; H929-D931 PolarHBondContact CE1-OD2 2.92Å; H929-D931 IonicContact ND1-OD1 2.75Å; H929-D931 PolarHBondContact ND1-OD1 3.4Å; H929-D931 VanDerWaalsContact ND1-OD1 3.16Å; H929-D931 IonicContact ND1-OD2 3.8Å; H929-D931 PolarHBondContact O-N 2.71Å; H929-K932 HydrophobicContact CB-CB 4.46Å; H929-K932 HydrophobicContact CB-CD 4.32Å; H929-K932 HydrophobicContact CB-CG 4.23Å; H929-K932 PolarHBondContact O-N 2.97Å; H929-A933 PolarHBondContact O-N 3.27Å; H929-F946 AromaticContact CD2-CE2 3.6Å
930	P	80.4	Confident	83.5	Confident	23 Å²	23	64.2 Å²	64.2	15%	0.149	33%	0.334	C	S	.	.	H	α-helix	trans	-54.9	-44.2	-177.1	18.6	-31.2	0	0	0	112.6	K932 A933 T934 K943 F946	P930-K932 PolarHBondContact O-N 2.82Å; P930-K932 VanDerWaalsContact O-N 3.14Å; P930-A933 CarbonylContact O-C 3.56Å; P930-A933 PolarHBondContact O-N 3.29Å; P930-T934 PolarHBondContact O-N 3.42Å; P930-T934 PolarHBondContact O-OG1 2.76Å; P930-K943 HydrophobicContact CB-CG 3.93Å; P930-F946 HydrophobicContact CG-CD1 4.49Å; P930-F946 HydrophobicContact CG-CE1 4.25Å; P930-F946 HydrophobicContact CG-CZ 4.36Å
931	D	79.1	Confident	83.1	Confident	119 Å²	119	64.4 Å²	64.4	64%	0.636	33%	0.333	S	S	*	.	H	α-helix	trans	-57.2	-30.1	179.5	-47	17.6	0	0	0	113.1	H929 T934	H929-D931 VanDerWaalsContact C-N 3.3Å; H929-D931 IonicContact CE1-OD1 3.62Å; H929-D931 PolarHBondContact CE1-OD1 3.4Å; H929-D931 IonicContact CE1-OD2 3.98Å; H929-D931 PolarHBondContact CE1-OD2 2.92Å; H929-D931 IonicContact ND1-OD1 2.75Å; H929-D931 PolarHBondContact ND1-OD1 3.4Å; H929-D931 VanDerWaalsContact ND1-OD1 3.16Å; H929-D931 IonicContact ND1-OD2 3.8Å; H929-D931 PolarHBondContact O-N 2.71Å; D931-T934 WeakPolarHBondContact CA-OG1 3.31Å
932	K	77.8	Confident	82.8	Confident	119 Å²	119	63.1 Å²	63.1	52%	0.517	33%	0.327	S	S	.	.	H	α-helix	trans	-87	-21	178.7	-65.2	-174.8	-175.8	-179.2	0	113.4	L926 H929 P930	L926-K932 WeakPolarHBondContact O-CD 3.22Å; L926-K932 PolarHBondContact O-NZ 3.31Å; H929-K932 HydrophobicContact CB-CB 4.46Å; H929-K932 HydrophobicContact CB-CD 4.32Å; H929-K932 HydrophobicContact CB-CG 4.23Å; H929-K932 PolarHBondContact O-N 2.97Å; P930-K932 PolarHBondContact O-N 2.82Å; P930-K932 VanDerWaalsContact O-N 3.14Å
933	A	77.1	Confident	82.6	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-97.5	0.6	174	0	0	0	0	0	112.3	H929 P930 G935 Q936 Y938 E939 A942	H929-A933 PolarHBondContact O-N 3.27Å; P930-A933 CarbonylContact O-C 3.56Å; P930-A933 PolarHBondContact O-N 3.29Å; A933-G935 PolarHBondContact O-N 2.82Å; A933-Q936 VanDerWaalsContact O-CB 3.26Å; A933-Q936 WeakPolarHBondContact O-CB 3.49Å; A933-Q936 PolarHBondContact O-N 2.87Å; A933-Y938 HydrophobicContact CB-CD2 4.08Å; A933-Y938 HydrophobicContact CB-CE2 4.05Å; A933-E939 WeakPolarHBondContact O-CB 3.29Å; A933-E939 WeakPolarHBondContact O-CG 3.48Å; A933-A942 HydrophobicContact CB-CB 3.52Å
934	T	73.9	Confident	82.3	Confident	85 Å²	85	55.7 Å²	55.7	52%	0.521	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	125.3	-178.1	-63.2	0	0	0	0	110.6	P930 D931 Q936 E939	P930-T934 PolarHBondContact O-N 3.42Å; P930-T934 PolarHBondContact O-OG1 2.76Å; D931-T934 WeakPolarHBondContact CA-OG1 3.31Å; T934-Q936 VanDerWaalsContact C-N 3.3Å; T934-E939 VanDerWaalsContact CA-OE2 3.31Å; T934-E939 WeakPolarHBondContact CA-OE2 3.34Å
935	G	71.6	Confident	82.2	Confident	67 Å²	67	55.7 Å²	55.7	69%	0.691	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	10.4	-173.6	0	0	0	0	0	115	A933 E939	A933-G935 PolarHBondContact O-N 2.82Å; G935-E939 PolarHBondContact N-OE2 2.85Å
936	Q	80.2	Confident	82.2	Confident	85 Å²	85	56.2 Å²	56.2	40%	0.397	30%	0.301	S	S	.	.	S	Bend	trans	-98.3	151.1	173	-61	-69.6	-51.2	0	0	110.7	A933 T934 Y938 E939	A933-Q936 VanDerWaalsContact O-CB 3.26Å; A933-Q936 WeakPolarHBondContact O-CB 3.49Å; A933-Q936 PolarHBondContact O-N 2.87Å; T934-Q936 VanDerWaalsContact C-N 3.3Å; Q936-Y938 HydrophobicContact CB-CD1 4.13Å; Q936-Y938 HydrophobicContact CB-CD2 4Å; Q936-Y938 HydrophobicContact CB-CE1 3.77Å; Q936-Y938 HydrophobicContact CB-CE2 3.64Å; Q936-Y938 HydrophobicContact CB-CG 4.24Å; Q936-Y938 HydrophobicContact CG-CE1 4.24Å; Q936-Y938 HydrophobicContact CG-CE2 3.92Å; Q936-Y938 WeakPolarHBondContact CG-OH 3.27Å; Q936-Y938 PolarHBondContact O-N 3.26Å; Q936-Y938 VanDerWaalsContact O-N 3.1Å; Q936-Y938 PolarHBondContact OE1-OH 3.36Å; Q936-E939 VanDerWaalsContact O-CB 3.3Å; Q936-E939 WeakPolarHBondContact O-CB 3.11Å; Q936-E939 PolarHBondContact O-N 3.18Å
937	P	77.1	Confident	82.2	Confident	117 Å²	117	57.8 Å²	57.8	76%	0.76	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.9	179	24.4	-34	0	0	0	113.3
938	Y	80.1	Confident	82.3	Confident	38 Å²	38	58.6 Å²	58.6	15%	0.149	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	12.3	176.6	51	-96.9	0	0	0	114.3	W897 A933 Q936 Q940 Y941 A942	W897-Y938 HydrophobicContact CB-CD1 4.21Å; W897-Y938 HydrophobicContact CB-CG 4.28Å; W897-Y938 AromaticContact CD1-CD1 3.88Å; W897-Y938 AromaticContact CD1-CE1 3.86Å; W897-Y938 AromaticContact CD2-CD1 3.96Å; W897-Y938 HydrophobicContact CD2-CD1 3.96Å; W897-Y938 AromaticContact CD2-CD2 3.47Å; W897-Y938 HydrophobicContact CD2-CD2 3.47Å; W897-Y938 VanDerWaalsContact CD2-CD2 3.47Å; W897-Y938 HydrophobicContact CD2-CE1 4.39Å; W897-Y938 AromaticContact CD2-CE2 3.92Å; W897-Y938 HydrophobicContact CD2-CE2 3.92Å; W897-Y938 AromaticContact CD2-CG 3.49Å; W897-Y938 HydrophobicContact CD2-CG 3.49Å; W897-Y938 VanDerWaalsContact CD2-CG 3.49Å; W897-Y938 AromaticContact CE2-CD2 3.49Å; W897-Y938 VanDerWaalsContact CE2-CD2 3.49Å; W897-Y938 AromaticContact CE2-CE2 3.42Å; W897-Y938 VanDerWaalsContact CE2-CE2 3.42Å; W897-Y938 AromaticContact CE2-CG 3.92Å; W897-Y938 AromaticContact CE2-CZ 3.82Å; W897-Y938 AromaticContact CE3-CD2 3.58Å; W897-Y938 HydrophobicContact CE3-CD2 3.58Å; W897-Y938 HydrophobicContact CE3-CE2 4.36Å; W897-Y938 AromaticContact CE3-CG 3.73Å; W897-Y938 HydrophobicContact CE3-CG 3.73Å; W897-Y938 AromaticContact CG-CD1 3.73Å; W897-Y938 HydrophobicContact CG-CD1 3.73Å; W897-Y938 HydrophobicContact CG-CD2 4.15Å; W897-Y938 HydrophobicContact CG-CE1 4.18Å; W897-Y938 AromaticContact CG-CG 3.73Å; W897-Y938 HydrophobicContact CG-CG 3.73Å; W897-Y938 AromaticContact CH2-CD2 3.76Å; W897-Y938 HydrophobicContact CH2-CD2 3.76Å; W897-Y938 AromaticContact CH2-CE2 3.96Å; W897-Y938 HydrophobicContact CH2-CE2 3.96Å; W897-Y938 AromaticContact CZ2-CD2 3.65Å; W897-Y938 HydrophobicContact CZ2-CD2 3.65Å; W897-Y938 AromaticContact CZ2-CE2 3.46Å; W897-Y938 HydrophobicContact CZ2-CE2 3.46Å; W897-Y938 VanDerWaalsContact CZ2-CE2 3.46Å; W897-Y938 AromaticContact CZ3-CD2 3.72Å; W897-Y938 HydrophobicContact CZ3-CD2 3.72Å; W897-Y938 HydrophobicContact CZ3-CE2 4.38Å; W897-Y938 HydrophobicContact CZ3-CG 4.33Å; W897-Y938 AromaticContact NE1-CE1 3.87Å; W897-Y938 AromaticContact NE1-CE2 3.79Å; W897-Y938 AromaticContact NE1-CZ 3.66Å; A933-Y938 HydrophobicContact CB-CD2 4.08Å; A933-Y938 HydrophobicContact CB-CE2 4.05Å; Q936-Y938 HydrophobicContact CB-CD1 4.13Å; Q936-Y938 HydrophobicContact CB-CD2 4Å; Q936-Y938 HydrophobicContact CB-CE1 3.77Å; Q936-Y938 HydrophobicContact CB-CE2 3.64Å; Q936-Y938 HydrophobicContact CB-CG 4.24Å; Q936-Y938 HydrophobicContact CG-CE1 4.24Å; Q936-Y938 HydrophobicContact CG-CE2 3.92Å; Q936-Y938 WeakPolarHBondContact CG-OH 3.27Å; Q936-Y938 PolarHBondContact O-N 3.26Å; Q936-Y938 VanDerWaalsContact O-N 3.1Å; Q936-Y938 PolarHBondContact OE1-OH 3.36Å; Y938-Q940 VanDerWaalsContact C-N 3.31Å; Y938-Q940 PolarHBondContact O-N 3.32Å; Y938-Y941 WeakPolarHBondContact O-CB 3.25Å; Y938-Y941 PolarHBondContact O-N 3.04Å; Y938-Y941 VanDerWaalsContact O-N 3.13Å; Y938-A942 PolarHBondContact O-N 3.37Å
939	E	82.4	Confident	82.4	Confident	51 Å²	51	58.6 Å²	58.6	24%	0.238	31%	0.31	C	S	.	.	H	α-helix	trans	-53.7	-45.5	-179.8	-169.8	-174.6	127.8	0	0	112.7	A933 T934 G935 Q936 Y941 A942 K943	A933-E939 WeakPolarHBondContact O-CB 3.29Å; A933-E939 WeakPolarHBondContact O-CG 3.48Å; T934-E939 VanDerWaalsContact CA-OE2 3.31Å; T934-E939 WeakPolarHBondContact CA-OE2 3.34Å; G935-E939 PolarHBondContact N-OE2 2.85Å; Q936-E939 VanDerWaalsContact O-CB 3.3Å; Q936-E939 WeakPolarHBondContact O-CB 3.11Å; Q936-E939 PolarHBondContact O-N 3.18Å; E939-Y941 VanDerWaalsContact C-N 3.33Å; E939-Y941 PolarHBondContact O-N 3.3Å; E939-A942 PolarHBondContact O-N 2.94Å; E939-K943 HydrophobicContact CG-CD 4.25Å; E939-K943 WeakPolarHBondContact O-CB 3.5Å; E939-K943 WeakPolarHBondContact O-CG 3.15Å; E939-K943 PolarHBondContact O-N 2.62Å; E939-K943 WeakPolarHBondContact OE1-CE 3.38Å; E939-K943 IonicContact OE1-NZ 2.93Å; E939-K943 PolarHBondContact OE1-NZ 3.46Å
940	Q	78.5	Confident	82.5	Confident	120 Å²	120	58.3 Å²	58.3	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-69	-33	-178.5	-170	164	3.1	0	0	112.1	Y938 M944	Y938-Q940 VanDerWaalsContact C-N 3.31Å; Y938-Q940 PolarHBondContact O-N 3.32Å; Q940-M944 WeakPolarHBondContact O-CG 3.13Å; Q940-M944 PolarHBondContact O-N 3.2Å
941	Y	84.4	Confident	82.9	Confident	22 Å²	22	60.7 Å²	60.7	9%	0.086	32%	0.322	C	S	.	.	H	α-helix	trans	-71.8	-45.8	176.2	-54.7	-33.3	0	0	0	111.8	D868 E870 K871 I874 Y938 E939 K943 M944 I945	D868-Y941 WeakPolarHBondContact CB-OH 3.48Å; D868-Y941 VanDerWaalsContact CG-OH 3.28Å; E870-Y941 HydrophobicContact CB-CD2 4.18Å; E870-Y941 HydrophobicContact CB-CE1 4.35Å; E870-Y941 HydrophobicContact CB-CE2 3.79Å; E870-Y941 HydrophobicContact CG-CE2 4.43Å; E870-Y941 WeakPolarHBondContact OE2-CE2 3.42Å; K871-Y941 HydrophobicContact CB-CE1 3.94Å; I874-Y941 HydrophobicContact CD1-CD1 3.75Å; I874-Y941 HydrophobicContact CD1-CG 3.8Å; Y938-Y941 WeakPolarHBondContact O-CB 3.25Å; Y938-Y941 PolarHBondContact O-N 3.04Å; Y938-Y941 VanDerWaalsContact O-N 3.13Å; E939-Y941 VanDerWaalsContact C-N 3.33Å; E939-Y941 PolarHBondContact O-N 3.3Å; Y941-K943 VanDerWaalsContact C-N 3.31Å; Y941-K943 PolarHBondContact O-N 2.61Å; Y941-M944 PolarHBondContact O-N 3.08Å; Y941-I945 WeakPolarHBondContact O-CG1 3.49Å; Y941-I945 PolarHBondContact O-N 2.86Å
942	A	86.2	Confident	83.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-56.2	-46.3	172.8	0	0	0	0	0	110.9	W897 V928 A933 Y938 E939 M944 I945 F946	W897-A942 HydrophobicContact CH2-CB 4.17Å; W897-A942 HydrophobicContact CZ3-CB 3.98Å; V928-A942 HydrophobicContact CB-CB 4.45Å; A933-A942 HydrophobicContact CB-CB 3.52Å; Y938-A942 PolarHBondContact O-N 3.37Å; E939-A942 PolarHBondContact O-N 2.94Å; A942-M944 PolarHBondContact O-N 2.63Å; A942-I945 PolarHBondContact O-N 3.12Å; A942-F946 WeakPolarHBondContact O-CB 3.49Å; A942-F946 PolarHBondContact O-N 2.79Å
943	K	85	Confident	83.9	Confident	93 Å²	93	50.1 Å²	50.1	40%	0.404	27%	0.269	S	S	.	.	H	α-helix	trans	-57.9	-44.6	174.8	-78.3	170.1	174.5	177.9	0	113.2	P930 E939 Y941 M947	P930-K943 HydrophobicContact CB-CG 3.93Å; E939-K943 HydrophobicContact CG-CD 4.25Å; E939-K943 WeakPolarHBondContact O-CB 3.5Å; E939-K943 WeakPolarHBondContact O-CG 3.15Å; E939-K943 PolarHBondContact O-N 2.62Å; E939-K943 WeakPolarHBondContact OE1-CE 3.38Å; E939-K943 IonicContact OE1-NZ 2.93Å; E939-K943 PolarHBondContact OE1-NZ 3.46Å; Y941-K943 VanDerWaalsContact C-N 3.31Å; Y941-K943 PolarHBondContact O-N 2.61Å; K943-M947 WeakPolarHBondContact O-CB 3.17Å; K943-M947 PolarHBondContact O-N 3.21Å
944	M	83.6	Confident	84.4	Confident	39 Å²	39	53.3 Å²	53.3	19%	0.192	29%	0.292	C	S	.	.	H	α-helix	trans	-64.1	-48.5	177.4	-75.5	175.4	61.9	0	0	112.2	K871 I874 L875 Q940 Y941 A942 M947 E948	K871-M944 HydrophobicContact CG-CE 4.31Å; K871-M944 HydrophobicContact CG-SD 4.23Å; I874-M944 HydrophobicContact CG2-CB 4.25Å; I874-M944 HydrophobicContact CG2-CE 3.96Å; L875-M944 HydrophobicContact CD2-CE 3.99Å; L875-M944 HydrophobicContact CG-CE 4.17Å; Q940-M944 WeakPolarHBondContact O-CG 3.13Å; Q940-M944 PolarHBondContact O-N 3.2Å; Y941-M944 PolarHBondContact O-N 3.08Å; A942-M944 PolarHBondContact O-N 2.63Å; M944-M947 PolarHBondContact O-N 3.37Å; M944-E948 PolarHBondContact O-N 3.26Å
945	I	89.2	Confident	84.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-41.8	-179.4	-61.4	163.7	0	0	0	110.6	I874 W877 M892 V895 V928 Y941 A942 M947 L949	I874-I945 HydrophobicContact CD1-CD1 4.1Å; I874-I945 HydrophobicContact CD1-CG1 4.29Å; I874-I945 HydrophobicContact CG1-CD1 4.19Å; I874-I945 HydrophobicContact CG1-CG1 4.25Å; I874-I945 HydrophobicContact CG2-CG1 4.1Å; W877-I945 HydrophobicContact CH2-CG2 4.07Å; W877-I945 HydrophobicContact CZ3-CG2 4.28Å; M892-I945 HydrophobicContact CG-CG2 4.28Å; M892-I945 HydrophobicContact SD-CG2 4.49Å; V895-I945 HydrophobicContact CB-CD1 4.43Å; V895-I945 HydrophobicContact CG2-CD1 4.05Å; V895-I945 HydrophobicContact CG2-CG1 4.44Å; V895-I945 WeakPolarHBondContact O-CD1 3.47Å; V928-I945 HydrophobicContact CG1-CB 4.42Å; V928-I945 HydrophobicContact CG1-CG2 4.08Å; V928-I945 HydrophobicContact CG2-CG2 4.23Å; Y941-I945 WeakPolarHBondContact O-CG1 3.49Å; Y941-I945 PolarHBondContact O-N 2.86Å; A942-I945 PolarHBondContact O-N 3.12Å; I945-M947 PolarHBondContact O-N 3.2Å; I945-L949 HydrophobicContact CG2-CD1 3.81Å; I945-L949 HydrophobicContact CG2-CG 4.36Å; I945-L949 WeakPolarHBondContact O-CB 2.94Å; I945-L949 WeakPolarHBondContact O-CG 3.49Å; I945-L949 PolarHBondContact O-N 3.12Å
946	F	90.3	Very high	85.6	Confident	39 Å²	39	49.2 Å²	49.2	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-42.6	175.4	-178.7	-93.3	0	0	0	112.3	V925 V928 H929 P930 A942 N950	V925-F946 HydrophobicContact CG1-CE2 3.91Å; V928-F946 HydrophobicContact CG2-CB 3.97Å; V928-F946 HydrophobicContact CG2-CD2 4.3Å; H929-F946 AromaticContact CD2-CE2 3.6Å; P930-F946 HydrophobicContact CG-CD1 4.49Å; P930-F946 HydrophobicContact CG-CE1 4.25Å; P930-F946 HydrophobicContact CG-CZ 4.36Å; A942-F946 WeakPolarHBondContact O-CB 3.49Å; A942-F946 PolarHBondContact O-N 2.79Å; F946-N950 VanDerWaalsContact CD1-ND2 3.33Å; F946-N950 WeakPolarHBondContact CD1-ND2 3.49Å; F946-N950 WeakPolarHBondContact CE1-ND2 3.44Å; F946-N950 WeakPolarHBondContact O-CB 3.42Å; F946-N950 PolarHBondContact O-N 3.4Å; F946-N950 PolarHBondContact O-ND2 3.34Å; F946-N950 PolarHBondContact O-OD1 3.02Å
947	M	86.8	Confident	85.8	Confident	135 Å²	135	48.8 Å²	48.8	67%	0.665	25%	0.247	S	C	*	.	H	α-helix	trans	-65.7	-47.7	-179.5	-170.6	175.3	71.5	0	0	112.3	K943 M944 I945 N950 D951	K943-M947 WeakPolarHBondContact O-CB 3.17Å; K943-M947 PolarHBondContact O-N 3.21Å; M944-M947 PolarHBondContact O-N 3.37Å; I945-M947 PolarHBondContact O-N 3.2Å; M947-N950 PolarHBondContact O-N 2.85Å; M947-D951 PolarHBondContact O-N 2.87Å
948	E	89.9	Confident	86	Confident	28 Å²	28	47.7 Å²	47.7	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-40.9	178	-179.7	61.2	-150.5	0	0	111.8	I878 E882 R883 L888 M944 N950 D951 A952	I878-E948 HydrophobicContact CD1-CB 3.98Å; I878-E948 HydrophobicContact CD1-CG 4.08Å; I878-E948 HydrophobicContact CG1-CB 4.4Å; I878-E948 HydrophobicContact CG1-CG 4.02Å; I878-E948 HydrophobicContact CG2-CG 4.12Å; E882-E948 WeakPolarHBondContact CA-OE1 3.46Å; R883-E948 PolarHBondContact N-OE1 3.13Å; L888-E948 HydrophobicContact CD1-CG 3.89Å; L888-E948 HydrophobicContact CD2-CG 4.42Å; M944-E948 PolarHBondContact O-N 3.26Å; E948-N950 VanDerWaalsContact C-N 3.27Å; E948-N950 PolarHBondContact O-N 2.86Å; E948-D951 PolarHBondContact O-N 2.72Å; E948-A952 WeakPolarHBondContact O-CB 3.37Å; E948-A952 PolarHBondContact O-N 3.01Å
949	L	90.6	Very high	85.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-36.9	175.5	-72.6	172.1	0	0	0	112	W877 I885 L888 L889 M892 Y921 A924 V928 I945 W953	W877-L949 HydrophobicContact CH2-CD2 4.48Å; I885-L949 HydrophobicContact CD1-CD2 3.85Å; L888-L949 HydrophobicContact CB-CD2 3.94Å; L889-L949 HydrophobicContact CD2-CD2 3.87Å; L889-L949 HydrophobicContact CG-CD2 4.28Å; M892-L949 HydrophobicContact SD-CD1 3.66Å; Y921-L949 HydrophobicContact CE2-CB 4.35Å; Y921-L949 WeakPolarHBondContact CE2-O 3.48Å; A924-L949 HydrophobicContact CB-CD1 4.02Å; V928-L949 HydrophobicContact CG2-CD1 4.13Å; I945-L949 HydrophobicContact CG2-CD1 3.81Å; I945-L949 HydrophobicContact CG2-CG 4.36Å; I945-L949 WeakPolarHBondContact O-CB 2.94Å; I945-L949 WeakPolarHBondContact O-CG 3.49Å; I945-L949 PolarHBondContact O-N 3.12Å; L949-W953 WeakPolarHBondContact O-CB 3.35Å; L949-W953 PolarHBondContact O-N 2.81Å
950	N	89.1	Confident	85.6	Confident	44 Å²	44	50.5 Å²	50.5	24%	0.235	27%	0.271	C	S	.	.	H	α-helix	trans	-69.9	-39.6	176.2	-70.4	-14.4	0	0	0	112.4	Y921 F946 M947 E948 S954	Y921-N950 PolarHBondContact OH-OD1 2.73Å; F946-N950 VanDerWaalsContact CD1-ND2 3.33Å; F946-N950 WeakPolarHBondContact CD1-ND2 3.49Å; F946-N950 WeakPolarHBondContact CE1-ND2 3.44Å; F946-N950 WeakPolarHBondContact O-CB 3.42Å; F946-N950 PolarHBondContact O-N 3.4Å; F946-N950 PolarHBondContact O-ND2 3.34Å; F946-N950 PolarHBondContact O-OD1 3.02Å; M947-N950 PolarHBondContact O-N 2.85Å; E948-N950 VanDerWaalsContact C-N 3.27Å; E948-N950 PolarHBondContact O-N 2.86Å; N950-S954 WeakPolarHBondContact O-CB 3.11Å; N950-S954 PolarHBondContact O-N 2.74Å; N950-S954 PolarHBondContact O-OG 3.34Å
951	D	88.8	Confident	85.6	Confident	73 Å²	73	47.7 Å²	47.7	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-68.5	-46.8	176.6	-165.1	56.6	0	0	0	111	M947 E948 W953 S954 E955	M947-D951 PolarHBondContact O-N 2.87Å; E948-D951 PolarHBondContact O-N 2.72Å; D951-W953 VanDerWaalsContact C-N 3.31Å; D951-W953 PolarHBondContact O-N 3.21Å; D951-S954 WeakPolarHBondContact O-CB 3.28Å; D951-S954 PolarHBondContact O-N 3.03Å; D951-S954 VanDerWaalsContact O-N 3.08Å; D951-E955 PolarHBondContact O-N 3.46Å
952	A	89.2	Confident	85.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-33.6	176.5	0	0	0	0	0	113.3	I885 L888 E948 F956	I885-A952 HydrophobicContact CB-CB 4.09Å; I885-A952 HydrophobicContact CD1-CB 4.14Å; L888-A952 HydrophobicContact CD1-CB 3.54Å; E948-A952 WeakPolarHBondContact O-CB 3.37Å; E948-A952 PolarHBondContact O-N 3.01Å; A952-F956 WeakPolarHBondContact O-CB 3.08Å; A952-F956 PolarHBondContact O-N 3.24Å
953	W	88.5	Confident	84.3	Confident	15 Å²	15	55.2 Å²	55.2	6%	0.057	30%	0.297	C	S	.	.	H	α-helix	trans	-67.6	-43.4	169.9	175.7	-93.9	0	0	0	112.1	I885 V917 K918 Y921 L949 D951 E955 F956 E957	I885-W953 HydrophobicContact CD1-CB 4.29Å; I885-W953 HydrophobicContact CG1-CB 4.46Å; I885-W953 HydrophobicContact CG1-CE3 4.28Å; V917-W953 HydrophobicContact CG1-CZ3 4.04Å; K918-W953 HydrophobicContact CB-CH2 3.54Å; K918-W953 HydrophobicContact CB-CZ2 4.4Å; K918-W953 HydrophobicContact CB-CZ3 4.12Å; K918-W953 HydrophobicContact CD-CH2 3.66Å; K918-W953 HydrophobicContact CD-CZ2 3.77Å; K918-W953 HydrophobicContact CG-CH2 3.45Å; K918-W953 VanDerWaalsContact CG-CH2 3.45Å; K918-W953 HydrophobicContact CG-CZ2 3.81Å; K918-W953 HydrophobicContact CG-CZ3 4.35Å; Y921-W953 HydrophobicContact CD1-CB 4.44Å; Y921-W953 AromaticContact CD1-CD2 3.34Å; Y921-W953 HydrophobicContact CD1-CD2 3.34Å; Y921-W953 AromaticContact CD1-CE2 3.8Å; Y921-W953 AromaticContact CD1-CE3 3.48Å; Y921-W953 HydrophobicContact CD1-CE3 3.48Å; Y921-W953 VanDerWaalsContact CD1-CE3 3.48Å; Y921-W953 AromaticContact CD1-CG 3.75Å; Y921-W953 HydrophobicContact CD1-CG 3.75Å; Y921-W953 HydrophobicContact CD1-CZ2 4.38Å; Y921-W953 HydrophobicContact CD1-CZ3 4.11Å; Y921-W953 HydrophobicContact CD2-CB 3.99Å; Y921-W953 HydrophobicContact CD2-CD2 4.24Å; Y921-W953 HydrophobicContact CD2-CE3 4.11Å; Y921-W953 HydrophobicContact CD2-CG 4.18Å; Y921-W953 HydrophobicContact CE1-CB 3.95Å; Y921-W953 AromaticContact CE1-CD1 3.49Å; Y921-W953 VanDerWaalsContact CE1-CD1 3.49Å; Y921-W953 AromaticContact CE1-CD2 3.37Å; Y921-W953 HydrophobicContact CE1-CD2 3.37Å; Y921-W953 AromaticContact CE1-CE2 3.73Å; Y921-W953 HydrophobicContact CE1-CE3 4.01Å; Y921-W953 AromaticContact CE1-CG 3.27Å; Y921-W953 HydrophobicContact CE1-CG 3.27Å; Y921-W953 AromaticContact CE1-NE1 3.74Å; Y921-W953 HydrophobicContact CE2-CB 3.43Å; Y921-W953 VanDerWaalsContact CE2-CB 3.43Å; Y921-W953 HydrophobicContact CE2-CD2 4.26Å; Y921-W953 AromaticContact CE2-CG 3.75Å; Y921-W953 HydrophobicContact CE2-CG 3.75Å; Y921-W953 HydrophobicContact CG-CB 4.44Å; Y921-W953 AromaticContact CG-CD2 3.79Å; Y921-W953 HydrophobicContact CG-CD2 3.79Å; Y921-W953 AromaticContact CG-CE3 3.52Å; Y921-W953 HydrophobicContact CG-CE3 3.52Å; Y921-W953 HydrophobicContact CG-CG 4.16Å; Y921-W953 HydrophobicContact CG-CZ3 4.23Å; Y921-W953 AromaticContact CZ-CD1 3.6Å; Y921-W953 AromaticContact CZ-CD2 3.83Å; Y921-W953 AromaticContact CZ-CG 3.24Å; L949-W953 WeakPolarHBondContact O-CB 3.35Å; L949-W953 PolarHBondContact O-N 2.81Å; D951-W953 VanDerWaalsContact C-N 3.31Å; D951-W953 PolarHBondContact O-N 3.21Å; W953-E955 VanDerWaalsContact C-N 3.34Å; W953-E955 PolarHBondContact O-N 2.8Å; W953-F956 HydrophobicContact CE3-CD1 4.12Å; W953-F956 HydrophobicContact CH2-CD1 4.14Å; W953-F956 HydrophobicContact CH2-CE1 4.3Å; W953-F956 AromaticContact CZ3-CD1 3.74Å; W953-F956 HydrophobicContact CZ3-CD1 3.74Å; W953-F956 HydrophobicContact CZ3-CE1 4.04Å; W953-F956 WeakPolarHBondContact O-CB 3.4Å; W953-F956 PolarHBondContact O-N 3.5Å; W953-F956 VanDerWaalsContact O-N 3.14Å; W953-E957 HydrophobicContact CD2-CG 4.42Å; W953-E957 VanDerWaalsContact CE2-CD 3.47Å; W953-E957 HydrophobicContact CH2-CG 4.37Å; W953-E957 HydrophobicContact CZ2-CG 3.56Å; W953-E957 WeakPolarHBondContact CZ2-OE1 3.21Å; W953-E957 PolarHBondContact NE1-OE2 3.49Å; W953-E957 PolarHBondContact O-N 2.94Å
954	S	86.2	Confident	83.1	Confident	69 Å²	69	54.1 Å²	54.1	48%	0.483	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-41.5	177.8	-60.5	0	0	0	0	111.5	N950 D951 E957 S958	N950-S954 WeakPolarHBondContact O-CB 3.11Å; N950-S954 PolarHBondContact O-N 2.74Å; N950-S954 PolarHBondContact O-OG 3.34Å; D951-S954 WeakPolarHBondContact O-CB 3.28Å; D951-S954 PolarHBondContact O-N 3.03Å; D951-S954 VanDerWaalsContact O-N 3.08Å; S954-E957 PolarHBondContact O-N 3.31Å; S954-S958 WeakPolarHBondContact O-CB 3.37Å; S954-S958 PolarHBondContact O-N 2.85Å
955	E	84.6	Confident	81.7	Confident	52 Å²	52	61.3 Å²	61.3	24%	0.243	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-41.3	172.9	-169.3	167.5	150.7	0	0	111.3	R883 D951 W953 E957 S958 Q959	R883-E955 VanDerWaalsContact CD-OE2 3.22Å; R883-E955 WeakPolarHBondContact CD-OE2 3.38Å; R883-E955 VanDerWaalsContact CG-OE2 3.28Å; R883-E955 WeakPolarHBondContact CG-OE2 3.49Å; R883-E955 IonicContact CZ-OE2 2.75Å; R883-E955 IonicContact NE-OE2 3.05Å; R883-E955 IonicContact NH1-OE2 2.66Å; R883-E955 PolarHBondContact NH1-OE2 3.5Å; D951-E955 PolarHBondContact O-N 3.46Å; W953-E955 VanDerWaalsContact C-N 3.34Å; W953-E955 PolarHBondContact O-N 2.8Å; E955-E957 PolarHBondContact O-N 2.84Å; E955-S958 WeakPolarHBondContact CA-OG 3.33Å; E955-S958 PolarHBondContact O-N 3.42Å; E955-S958 VanDerWaalsContact O-N 3.13Å; E955-S958 PolarHBondContact O-OG 2.69Å; E955-Q959 HydrophobicContact CG-CG 4.22Å; E955-Q959 WeakPolarHBondContact O-CG 3.2Å; E955-Q959 PolarHBondContact O-N 2.78Å; E955-Q959 PolarHBondContact OE1-NE2 2.79Å
956	F	86.3	Confident	79.3	Confident	13 Å²	13	67.7 Å²	67.7	6%	0.057	37%	0.367	C	S	.	.	H	α-helix	trans	-60.9	-39.1	176.1	179.7	-114.3	0	0	0	113.7	I885 P914 V917 A952 W953 Q961	I885-F956 HydrophobicContact CG2-CB 3.68Å; I885-F956 HydrophobicContact CG2-CD1 4.17Å; I885-F956 HydrophobicContact CG2-CD2 4.14Å; I885-F956 HydrophobicContact CG2-CG 3.73Å; P914-F956 HydrophobicContact CB-CE1 4.32Å; P914-F956 HydrophobicContact CB-CZ 4.02Å; V917-F956 HydrophobicContact CB-CE1 4.18Å; V917-F956 HydrophobicContact CB-CZ 4.48Å; V917-F956 HydrophobicContact CG1-CD1 4.39Å; V917-F956 HydrophobicContact CG1-CE1 4.11Å; V917-F956 HydrophobicContact CG2-CZ 4.48Å; A952-F956 WeakPolarHBondContact O-CB 3.08Å; A952-F956 PolarHBondContact O-N 3.24Å; W953-F956 HydrophobicContact CE3-CD1 4.12Å; W953-F956 HydrophobicContact CH2-CD1 4.14Å; W953-F956 HydrophobicContact CH2-CE1 4.3Å; W953-F956 AromaticContact CZ3-CD1 3.74Å; W953-F956 HydrophobicContact CZ3-CD1 3.74Å; W953-F956 HydrophobicContact CZ3-CE1 4.04Å; W953-F956 WeakPolarHBondContact O-CB 3.4Å; W953-F956 PolarHBondContact O-N 3.5Å; W953-F956 VanDerWaalsContact O-N 3.14Å; F956-Q961 HydrophobicContact CD1-CG 4.37Å; F956-Q961 HydrophobicContact CE1-CB 4.29Å; F956-Q961 HydrophobicContact CE1-CG 4.06Å; F956-Q961 HydrophobicContact CZ-CB 4.25Å; F956-Q961 PolarHBondContact O-N 2.88Å; F956-Q961 VanDerWaalsContact O-N 3.15Å
957	E	85.7	Confident	78.8	Confident	77 Å²	77	69.2 Å²	69.2	36%	0.36	38%	0.376	S	S	.	.	H	α-helix	trans	-68.6	-40.3	172	-66.7	-157.6	116.3	0	0	111.5	K918 W953 S954 E955 Q959 G960 Q961	K918-E957 IonicContact NZ-OE1 2.68Å; K918-E957 PolarHBondContact NZ-OE1 3.5Å; W953-E957 HydrophobicContact CD2-CG 4.42Å; W953-E957 VanDerWaalsContact CE2-CD 3.47Å; W953-E957 HydrophobicContact CH2-CG 4.37Å; W953-E957 HydrophobicContact CZ2-CG 3.56Å; W953-E957 WeakPolarHBondContact CZ2-OE1 3.21Å; W953-E957 PolarHBondContact NE1-OE2 3.49Å; W953-E957 PolarHBondContact O-N 2.94Å; S954-E957 PolarHBondContact O-N 3.31Å; E955-E957 PolarHBondContact O-N 2.84Å; E957-Q959 VanDerWaalsContact C-N 3.29Å; E957-Q959 PolarHBondContact O-N 3.26Å; E957-G960 PolarHBondContact O-N 3.45Å; E957-G960 VanDerWaalsContact O-N 3.07Å; E957-Q961 HydrophobicContact CG-CG 4.31Å; E957-Q961 PolarHBondContact OE1-NE2 2.92Å
958	S	79.7	Confident	78.3	Confident	93 Å²	93	65.7 Å²	65.7	65%	0.65	36%	0.361	S	S	*	.	H	α-helix	trans	-62.9	-31.7	176.1	81.7	0	0	0	0	113.9	S954 E955 G960	S954-S958 WeakPolarHBondContact O-CB 3.37Å; S954-S958 PolarHBondContact O-N 2.85Å; E955-S958 WeakPolarHBondContact CA-OG 3.33Å; E955-S958 PolarHBondContact O-N 3.42Å; E955-S958 VanDerWaalsContact O-N 3.13Å; E955-S958 PolarHBondContact O-OG 2.69Å; S958-G960 PolarHBondContact O-N 2.95Å
959	Q	77.9	Confident	77.7	Confident	94 Å²	94	67.8 Å²	67.8	44%	0.439	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	0.5	177.3	-70.4	-171	25.2	0	0	113.1	E955 E957 K962	E955-Q959 HydrophobicContact CG-CG 4.22Å; E955-Q959 WeakPolarHBondContact O-CG 3.2Å; E955-Q959 PolarHBondContact O-N 2.78Å; E955-Q959 PolarHBondContact OE1-NE2 2.79Å; E957-Q959 VanDerWaalsContact C-N 3.29Å; E957-Q959 PolarHBondContact O-N 3.26Å; Q959-K962 WeakPolarHBondContact O-CE 3.05Å; Q959-K962 PolarHBondContact O-NZ 3.19Å
960	G	76.8	Confident	76.9	Confident	55 Å²	55	71.8 Å²	71.8	57%	0.567	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	31.2	177.6	0	0	0	0	0	114.1	E957 S958 K962	E957-G960 PolarHBondContact O-N 3.45Å; E957-G960 VanDerWaalsContact O-N 3.07Å; S958-G960 PolarHBondContact O-N 2.95Å; G960-K962 PolarHBondContact O-N 3.34Å
961	Q	79.8	Confident	76.2	Confident	61 Å²	61	73.5 Å²	73.5	29%	0.285	41%	0.406	S	S	.	.			trans	50.6	54.5	170.6	-69	-179.6	22.3	0	0	113.7	P914 F956 E957	P914-Q961 HydrophobicContact CB-CB 3.97Å; P914-Q961 HydrophobicContact CG-CB 4.37Å; P914-Q961 WeakPolarHBondContact CG-O 3.41Å; F956-Q961 HydrophobicContact CD1-CG 4.37Å; F956-Q961 HydrophobicContact CE1-CB 4.29Å; F956-Q961 HydrophobicContact CE1-CG 4.06Å; F956-Q961 HydrophobicContact CZ-CB 4.25Å; F956-Q961 PolarHBondContact O-N 2.88Å; F956-Q961 VanDerWaalsContact O-N 3.15Å; E957-Q961 HydrophobicContact CG-CG 4.31Å; E957-Q961 PolarHBondContact OE1-NE2 2.92Å
962	K	72.6	Confident	75.3	Confident	119 Å²	119	73.5 Å²	73.5	52%	0.517	41%	0.407	S	S	.	.			trans	-73.7	139.5	-174.2	-69.9	168	179.9	158.2	0	113	R886 Q959 G960	R886-K962 PolarHBondContact NH1-O 2.89Å; R886-K962 PolarHBondContact NH2-O 3.48Å; Q959-K962 WeakPolarHBondContact O-CE 3.05Å; Q959-K962 PolarHBondContact O-NZ 3.19Å; G960-K962 PolarHBondContact O-N 3.34Å
963	P	69.6	Low	74.3	Confident	61 Å²	61	78.8 Å²	78.8	40%	0.396	44%	0.436	S	S	.	.			trans	-65.6	163.6	171	31.1	-36.1	0	0	0	111	Y965	P963-Y965 VanDerWaalsContact C-N 3.25Å; P963-Y965 PolarHBondContact O-N 2.93Å
964	L	59	Low	73.2	Confident	69 Å²	69	83.7 Å²	83.7	36%	0.361	47%	0.465	S	S	.	.	S	Bend	trans	-72.4	-15.7	178.9	-111.9	168.4	0	0	0	114.3	M908 V912	M908-L964 HydrophobicContact CE-CD1 4.05Å; V912-L964 HydrophobicContact CG1-CB 4.28Å; V912-L964 PolarHBondContact O-N 3.13Å; V912-L964 VanDerWaalsContact O-N 3.11Å
965	Y	54.5	Low	72.2	Confident	190 Å²	190	84.9 Å²	84.9	75%	0.745	46%	0.464	S	S	*	.			trans	-123.4	105.6	177.9	-61.7	-75.9	0	0	0	110.2	V912 P963	V912-Y965 HydrophobicContact CG1-CD2 3.89Å; V912-Y965 HydrophobicContact CG1-CE2 4.01Å; V912-Y965 HydrophobicContact CG2-CE2 4.46Å; P963-Y965 VanDerWaalsContact C-N 3.25Å; P963-Y965 PolarHBondContact O-N 2.93Å
966	S	39.5	Very low	71	Confident	135 Å²	135	87.9 Å²	87.9	94%	0.944	48%	0.484	S	S	*	.			trans	-161	0	169.8	69.8	0	0	0	0	111.9	R369	R369-S966 PolarHBondContact NH2-O 3.44Å; R369-S966 VanDerWaalsContact NH2-O 3.12Å

Retrieved 966 of 966 residues in 1283.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).