A0A096MLF1_PAPAN Loading...

YTH domain-containing family protein

Specifically recognizes and binds N6-methyladenosine (m6A)-containing RNAs, and regulates mRNA stability. M6A is a modification present at internal sites of mRNAs and some non-coding RNAs and plays a role in mRNA stability and processing.

AlphaFold DB (A0A2K5MKH9), UniProt , Accession A0A096MLF1, Species PAPAN (Papio anubis, Olive baboon), Gene YTHDC1, Length 736 aa.

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	31.5	Very low	36.8	Very low	248 Å²	248	154.1 Å²	154.1	100%	1.222	82%	0.82	S	S	*	*				0	139.4	0	-57.5	168.1	-179.2	0	0	106.7
2	A	34	Very low	36.7	Very low	91 Å²	91	157.3 Å²	157.3	75%	0.752	83%	0.827	S	S	*	*			cis	176.6	137.6	-29	0	0	0	0	0	105.6
3	A	37.4	Very low	37.2	Very low	86 Å²	86	157.3 Å²	157.3	71%	0.711	83%	0.826	S	S	*	*			trans	62.8	157.9	175	0	0	0	0	0	117
4	D	38.4	Very low	37.1	Very low	138 Å²	138	157.1 Å²	157.1	74%	0.738	83%	0.826	S	S	*	*			cis	-158.2	148.3	-24.8	-100.4	-23.2	0	0	0	112.1
5	I	41.3	Very low	37.5	Very low	133 Å²	133	155.5 Å²	155.5	68%	0.682	83%	0.825	S	S	*	*			trans	22.1	120.2	140.5	-35.4	168.5	0	0	0	120
6	R	37.3	Very low	37.7	Very low	222 Å²	222	156.3 Å²	156.3	84%	0.838	83%	0.828	S	S	*	*				168.3	120.3	119.8	-90.4	172.1	176.5	149.3	2.9	109.7
7	E	36.9	Very low	38.1	Very low	172 Å²	172	156.3 Å²	156.3	80%	0.804	83%	0.829	S	S	*	*				89	128.7	53.5	-167.4	173.2	-121.3	0	0	112
8	E	42.3	Very low	38.3	Very low	175 Å²	175	156.4 Å²	156.4	82%	0.818	83%	0.83	S	S	*	*			trans	-85.1	164.6	-165.4	-62.1	159.2	132.7	0	0	113.3
9	K	36.2	Very low	38.6	Very low	204 Å²	204	157.1 Å²	157.1	89%	0.887	83%	0.832	S	S	*	*			trans	-162.9	119.3	144.1	-120.7	169.5	-174.4	176.4	0	113.8
10	D	37.3	Very low	38.7	Very low	154 Å²	154	157.4 Å²	157.4	82%	0.824	83%	0.833	S	S	*	*			trans	-73.5	163.6	162.4	-59.9	-72.4	0	0	0	111.6
11	G	32.6	Very low	38.7	Very low	72 Å²	72	156.5 Å²	156.5	74%	0.742	83%	0.834	S	S	*	*			trans	-164.5	88.4	179.2	0	0	0	0	0	110.4
12	E	35.5	Very low	39.1	Very low	193 Å²	193	153.9 Å²	153.9	90%	0.902	82%	0.819	S	S	*	*			trans	-65.1	142.9	-179	-58.9	172.1	127.3	0	0	111.3
13	L	42.4	Very low	39.6	Very low	157 Å²	157	155.4 Å²	155.4	82%	0.822	82%	0.819	S	S	*	*			trans	-135.1	142.8	172.4	-79	176.2	0	0	0	111.3
14	N	36.4	Very low	40.1	Very low	154 Å²	154	157.5 Å²	157.5	82%	0.824	83%	0.825	S	S	*	*			trans	-60.2	139.4	-168.6	-54.5	-26.7	0	0	0	113.3
15	V	42.8	Very low	40.1	Very low	134 Å²	134	159 Å²	159	81%	0.812	83%	0.827	S	S	*	*			trans	-127.2	57	177.5	-165.4	0	0	0	0	110.4
16	L	40.8	Very low	40	Very low	168 Å²	168	161.6 Å²	161.6	88%	0.88	84%	0.836	S	S	*	*	S	Bend	trans	-138.4	15.5	-176.7	-77.7	179.6	0	0	0	115.7
17	D	44	Very low	40	Very low	156 Å²	156	157.9 Å²	157.9	83%	0.834	83%	0.833	S	S	*	*	S	Bend	trans	-115.6	-1.2	178.3	-81.4	-55.9	0	0	0	114.7
18	D	41.7	Very low	40.3	Very low	159 Å²	159	157.1 Å²	157.1	85%	0.85	84%	0.835	S	S	*	*	S	Bend	trans	-122.2	29.6	-158.3	-139.6	16	0	0	0	115.2
19	I	45.1	Very low	40.3	Very low	169 Å²	169	158.1 Å²	158.1	87%	0.867	84%	0.84	S	S	*	*			trans	-134.5	60.1	173.3	-43.7	-179.9	0	0	0	111
20	L	41.1	Very low	40.6	Very low	162 Å²	162	156.7 Å²	156.7	85%	0.848	84%	0.841	S	S	*	*	S	Bend	trans	-148.4	33.2	173.5	-124.9	177.3	0	0	0	115.8
21	T	37	Very low	40.6	Very low	140 Å²	140	159.1 Å²	159.1	86%	0.859	84%	0.84	S	S	*	*			trans	-154.5	117.2	162.5	17	0	0	0	0	111.4
22	E	39.7	Very low	40.9	Very low	192 Å²	192	161 Å²	161	90%	0.897	83%	0.833	S	S	*	*				179.4	148	117.4	-98.3	-175.9	-177.6	0	0	110.8
23	V	45.9	Very low	41.2	Very low	124 Å²	124	157.2 Å²	157.2	75%	0.752	83%	0.825	S	S	*	*			trans	-128.1	136.9	-176.7	170	0	0	0	0	108.8	E25	V23-E25 HydrophobicContact CG1-CG 4.1Å
24	P	47.9	Very low	40.9	Very low	130 Å²	130	157.7 Å²	157.7	84%	0.844	82%	0.823	S	S	*	*			trans	-105.9	118.3	152.9	-3.6	24.2	0	0	0	110.5
25	E	38.6	Very low	40.9	Very low	169 Å²	169	154.9 Å²	154.9	79%	0.79	82%	0.816	S	S	*	*			trans	-78.4	141.2	168.5	-61.9	169.8	127.8	0	0	110.5	V23	V23-E25 HydrophobicContact CG1-CG 4.1Å
26	Q	38.4	Very low	40.4	Very low	187 Å²	187	158 Å²	158	87%	0.874	82%	0.821	S	S	*	*			trans	-166.5	98	147.2	-114.9	154.8	64.2	0	0	111.8
27	D	37.6	Very low	40	Very low	144 Å²	144	159.2 Å²	159.2	77%	0.77	82%	0.822	S	S	*	*			trans	30.8	108.4	136.3	-54	4.1	0	0	0	117.4
28	D	42.9	Very low	39.6	Very low	157 Å²	157	158.7 Å²	158.7	84%	0.84	82%	0.819	S	S	*	*				76.2	103	81.5	-95.9	-4.6	0	0	0	114.8
29	E	42.1	Very low	39.2	Very low	196 Å²	196	160.3 Å²	160.3	92%	0.916	82%	0.819	S	S	*	*			trans	-154.2	143.3	137.6	-125.8	177.9	-146.3	0	0	110.7
30	L	42.7	Very low	38.5	Very low	174 Å²	174	158.9 Å²	158.9	91%	0.911	81%	0.813	S	S	*	*			trans	-84.7	140.7	-167	-63.4	101.9	0	0	0	113.4
31	Y	36.4	Very low	38.1	Very low	204 Å²	204	158.1 Å²	158.1	80%	0.8	81%	0.805	S	S	*	*			trans	-114.2	117.1	164.2	-166	-100.7	0	0	0	112
32	N	38.9	Very low	38.1	Very low	113 Å²	113	158.4 Å²	158.4	60%	0.604	80%	0.795	S	S	*	*			trans	-99.5	124.8	-176.5	-178.4	49.3	0	0	0	111.4	E34	N32-E34 VanDerWaalsContact C-N 3.29Å; N32-E34 PolarHBondContact O-N 2.69Å
33	P	42.5	Very low	38	Very low	112 Å²	112	158.9 Å²	158.9	73%	0.727	79%	0.794	S	S	*	*	S	Bend	trans	-84.3	44.4	-168.9	35.5	-38.3	0	0	0	115.2
34	E	36.8	Very low	37.4	Very low	167 Å²	167	156.5 Å²	156.5	78%	0.78	79%	0.794	S	S	*	*			trans	-135.8	66.8	178	-71.6	-158.8	138.7	0	0	113.9	N32	N32-E34 VanDerWaalsContact C-N 3.29Å; N32-E34 PolarHBondContact O-N 2.69Å
35	S	34.9	Very low	36.7	Very low	96 Å²	96	154.9 Å²	154.9	67%	0.671	79%	0.786	S	S	*	*			trans	-158.9	58.1	171.6	70	0	0	0	0	117.2
36	E	33.7	Very low	36.6	Very low	198 Å²	198	154.7 Å²	154.7	93%	0.925	78%	0.782	S	S	*	*			trans	-134.8	72	160.6	-79.1	-145.5	135.6	0	0	113.6
37	Q	33	Very low	36.6	Very low	195 Å²	195	156.3 Å²	156.3	91%	0.911	78%	0.78	S	S	*	*			trans	-133.7	110.7	147.1	-73.7	-169.9	-4	0	0	108.3
38	D	34.9	Very low	36.6	Very low	144 Å²	144	157.7 Å²	157.7	77%	0.77	78%	0.78	S	S	*	*				161.6	142.5	105.6	-147.5	-11.6	0	0	0	112.1
39	K	33.8	Very low	36.1	Very low	194 Å²	194	153.6 Å²	153.6	84%	0.843	76%	0.763	S	S	*	*			trans	160.7	103.1	139.8	-86.9	150.2	-163.7	156.1	0	111.9
40	N	28.7	Very low	35.6	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	75%	0.752	S	S	*	*				-155.9	112.3	108.4	-137.7	-29.8	0	0	0	114.2
41	E	32.6	Very low	35.2	Very low	147 Å²	147	151 Å²	151	69%	0.687	74%	0.742	S	S	*	*			trans	7.7	125.9	154.1	-52.9	-178.1	172.7	0	0	121.4
42	K	37.8	Very low	35.3	Very low	146 Å²	146	148 Å²	148	64%	0.635	74%	0.738	S	S	*	*				178.5	131.4	95.8	-97.7	147	-166.3	74.9	0	114.3
43	K	36.9	Very low	35.1	Very low	202 Å²	202	150.1 Å²	150.1	88%	0.878	74%	0.744	S	S	*	*			trans	59.8	123.2	149.2	-55.2	166.3	-176.7	176.6	0	117.8
44	G	33.3	Very low	34.5	Very low	73 Å²	73	149.4 Å²	149.4	75%	0.753	74%	0.741	S	S	*	*			cis	145.8	179.2	-7.7	0	0	0	0	0	113.9
45	S	33.4	Very low	34.4	Very low	97 Å²	97	147.9 Å²	147.9	68%	0.678	74%	0.743	S	S	*	*			trans	73.3	100.2	161	177.1	0	0	0	0	120.6
46	K	36.3	Very low	34.3	Very low	164 Å²	164	150.1 Å²	150.1	71%	0.713	75%	0.748	S	S	*	*			trans	87.9	121.4	131.4	-70.5	172.6	-170	158.6	0	121.6
47	R	40.3	Very low	34.3	Very low	222 Å²	222	147.7 Å²	147.7	84%	0.838	75%	0.747	S	S	*	*			trans	74.2	144.9	137.9	-64.4	168.4	179.4	-177.6	-4.2	116.2
48	K	36.5	Very low	34.3	Very low	173 Å²	173	147.1 Å²	147.1	75%	0.752	74%	0.741	S	S	*	*			cis	-150.7	166	-5.6	-139.4	-161.2	162.6	-137.8	0	110.7	D50	K48-D50 IonicContact NZ-OD2 3.8Å
49	S	32.4	Very low	34.3	Very low	70 Å²	70	150.7 Å²	150.7	49%	0.49	74%	0.744	S	S	.	*			trans	-35.4	150.5	153.7	64.4	0	0	0	0	113.6
50	D	31.9	Very low	34.2	Very low	128 Å²	128	149.7 Å²	149.7	68%	0.684	74%	0.742	S	S	*	*				179.4	169.4	63.9	-89.3	-60.8	0	0	0	107.2	K48	K48-D50 IonicContact NZ-OD2 3.8Å
51	R	33.6	Very low	34.6	Very low	188 Å²	188	152.3 Å²	152.3	71%	0.709	75%	0.747	S	S	*	*			cis	177	123	-15.3	168.2	-171.6	168	165.9	2	110.4
52	M	38	Very low	35.2	Very low	142 Å²	142	151.3 Å²	151.3	70%	0.7	75%	0.753	S	S	*	*			trans	60	167.9	152.5	-57.9	165.5	-174.1	0	0	117.5
53	E	35.1	Very low	34.9	Very low	157 Å²	157	149.9 Å²	149.9	73%	0.734	76%	0.762	S	S	*	*			cis	-150	172.6	-6	-135.1	164.5	119.3	0	0	112.1
54	S	31.1	Very low	34.6	Very low	97 Å²	97	146 Å²	146	68%	0.678	76%	0.755	S	S	*	*			trans	-20.7	160	161.1	-47.5	0	0	0	0	118.7
55	T	34	Very low	34.6	Very low	134 Å²	134	151 Å²	151	82%	0.822	76%	0.758	S	S	*	*				-158.3	157.7	50.5	47.5	0	0	0	0	116.7
56	D	32.2	Very low	34.5	Very low	143 Å²	143	152 Å²	152	77%	0.765	77%	0.765	S	S	*	*			trans	-55.3	155.9	162.6	-83.2	-97.1	0	0	0	115.5
57	T	33.8	Very low	34.4	Very low	148 Å²	148	154.2 Å²	154.2	91%	0.908	77%	0.769	S	S	*	*				-171.7	159.4	107	22	0	0	0	0	115.9
58	K	33.9	Very low	34.1	Very low	183 Å²	183	150.3 Å²	150.3	80%	0.796	76%	0.76	S	S	*	*			trans	-74.7	157.1	-170.4	-67.5	166.4	173.5	166.4	0	115.4
59	R	34.3	Very low	33.9	Very low	219 Å²	219	148.8 Å²	148.8	83%	0.826	76%	0.76	S	S	*	*			trans	49.4	140.3	140.6	-69.6	179.9	169.1	-147.7	-1.9	117.9
60	Q	32.3	Very low	33.9	Very low	173 Å²	173	151.7 Å²	151.7	81%	0.808	77%	0.774	S	S	*	*			cis	-168.4	163.4	46	-146.7	160.4	-12.7	0	0	111.5
61	K	36.3	Very low	33.9	Very low	193 Å²	193	150 Å²	150	84%	0.839	77%	0.772	S	S	*	*			trans	-86.4	170.8	163	-69.3	-175.2	178.4	-176.6	0	109.4
62	P	46.8	Very low	34.1	Very low	125 Å²	125	150.3 Å²	150.3	81%	0.812	78%	0.778	S	S	*	*			cis	-142.1	-179.7	15.9	44.1	-25.9	0	0	0	117.1
63	S	30	Very low	34.9	Very low	117 Å²	117	148.7 Å²	148.7	82%	0.818	78%	0.778	S	S	*	*			trans	-168	-179.4	138.5	-160.1	0	0	0	0	110.7
64	V	31.6	Very low	34.8	Very low	121 Å²	121	148.7 Å²	148.7	73%	0.733	78%	0.783	S	S	*	*			trans	-136.8	157.1	-163.8	-110.2	0	0	0	0	114.7
65	H	33.8	Very low	34.9	Very low	178 Å²	178	149.2 Å²	149.2	82%	0.824	79%	0.786	S	S	*	*			trans	56.9	126.1	157.7	-80	85	0	0	0	120.3
66	S	30.2	Very low	35.1	Very low	116 Å²	116	147.7 Å²	147.7	81%	0.811	78%	0.781	S	S	*	*				-174.5	169.5	93.3	-154.7	0	0	0	0	114.9
67	R	33.5	Very low	35.3	Very low	212 Å²	212	145.7 Å²	145.7	80%	0.8	78%	0.778	S	S	*	*			trans	-63.4	171.3	175.3	-74.4	176.4	-175.2	-150.9	6	113.7
68	Q	34.7	Very low	35.3	Very low	140 Å²	140	145.6 Å²	145.6	65%	0.654	78%	0.777	S	S	*	*			cis	176	-179.2	-14.5	-177.8	177.3	-3.2	0	0	108.2
69	L	33	Very low	35.4	Very low	141 Å²	141	141.8 Å²	141.8	74%	0.738	77%	0.774	S	S	*	*			trans	91.9	116.4	157.5	-53.6	174.3	0	0	0	122.4
70	V	32.3	Very low	35.2	Very low	131 Å²	131	139.1 Å²	139.1	79%	0.794	78%	0.776	S	S	*	*			trans	3.3	153.3	133.5	-114.6	0	0	0	0	119.9
71	S	31.9	Very low	35.3	Very low	91 Å²	91	137.3 Å²	137.3	64%	0.636	77%	0.772	S	S	*	*			cis	179.7	159.9	35.9	47.4	0	0	0	0	117
72	K	36.9	Very low	35.4	Very low	195 Å²	195	137.8 Å²	137.8	85%	0.848	77%	0.774	S	S	*	*			trans	68.2	168.3	145.9	-74	171	-178	179.9	0	119.6
73	P	55.3	Low	34.9	Very low	108 Å²	108	141.9 Å²	141.9	70%	0.701	77%	0.773	S	S	*	*				-145.3	-173.9	-54.5	45.1	-28	0	0	0	117.3
74	L	32.6	Very low	35.4	Very low	157 Å²	157	143.4 Å²	143.4	82%	0.822	77%	0.771	S	S	*	*			trans	90.6	123.8	149	-73.9	171.7	0	0	0	125.6
75	S	33.9	Very low	35.5	Very low	108 Å²	108	144.1 Å²	144.1	76%	0.755	78%	0.775	S	S	*	*			trans	62.3	150.1	142.4	54.3	0	0	0	0	123
76	S	37.6	Very low	35.5	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	77%	0.769	S	S	*	*			cis	-171.4	173.2	-15.7	56	0	0	0	0	114.1
77	S	36.7	Very low	35.8	Very low	101 Å²	101	142 Å²	142	71%	0.706	77%	0.774	S	S	*	*			trans	83.6	128.6	137.2	49	0	0	0	0	125.6
78	V	33.2	Very low	36	Very low	146 Å²	146	141.6 Å²	141.6	89%	0.885	78%	0.778	S	S	*	*			trans	94.2	150.9	138.8	168.1	0	0	0	0	121
79	S	36.2	Very low	35.9	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	78%	0.783	S	S	*	*			trans	-136.7	176.2	-161.2	61	0	0	0	0	113
80	N	29.8	Very low	36.4	Very low	163 Å²	163	141.3 Å²	141.3	87%	0.872	79%	0.789	S	S	*	*			trans	-160.3	161	161.6	-116.6	-60.7	0	0	0	113.8
81	N	35.3	Very low	36.6	Very low	136 Å²	136	139.7 Å²	139.7	73%	0.727	78%	0.784	S	S	*	*			trans	-154.9	141.7	-168.1	-139.7	-34.8	0	0	0	112.4
82	K	37.1	Very low	36.8	Very low	202 Å²	202	141.5 Å²	141.5	88%	0.878	79%	0.791	S	S	*	*			trans	-161.1	169.6	172	-124.5	168.2	-174.6	172.6	0	115.2
83	R	37.5	Very low	36.7	Very low	212 Å²	212	138.9 Å²	138.9	80%	0.8	79%	0.791	S	S	*	*			trans	-160.5	173.7	-168.6	-108.6	175.7	-79.9	155.5	-4.5	110.1
84	I	39.8	Very low	35.4	Very low	149 Å²	149	142.8 Å²	142.8	76%	0.764	80%	0.8	S	S	*	*			cis	-109.2	-117.8	6.3	-44.3	168.7	0	0	0	111
85	V	33.2	Very low	35.2	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	80%	0.802	S	S	*	*			cis	-136.4	-150.9	6.2	-152.7	0	0	0	0	110.5
86	S	34.7	Very low	35.1	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	81%	0.805	S	S	*	*			trans	-159.3	148.9	-170.5	178.7	0	0	0	0	114.3
87	T	36.2	Very low	34.5	Very low	149 Å²	149	150 Å²	150	91%	0.914	80%	0.799	S	S	*	*			trans	-155.8	-177.7	135.5	32.7	0	0	0	0	109.2
88	K	37.9	Very low	34.3	Very low	203 Å²	203	152.8 Å²	152.8	88%	0.883	80%	0.801	S	S	*	*			trans	-133.8	130	-141.3	176.4	-178.7	176.7	-177.6	0	116.1
89	G	32	Very low	34.1	Very low	73 Å²	73	153.2 Å²	153.2	75%	0.753	79%	0.793	S	S	*	*			trans	-164.7	162.5	169.7	0	0	0	0	0	111.6
90	K	44.3	Very low	33.8	Very low	203 Å²	203	156.8 Å²	156.8	88%	0.883	79%	0.792	S	S	*	*			trans	-129	170.9	-178	-50.4	-174.3	174.9	-175.3	0	110.5
91	S	36.2	Very low	33.7	Very low	97 Å²	97	154.5 Å²	154.5	68%	0.678	78%	0.776	S	S	*	*			cis	-166.5	149.5	20.7	54.7	0	0	0	0	115
92	V	36	Very low	33.4	Very low	129 Å²	129	158.3 Å²	158.3	78%	0.782	78%	0.781	S	S	*	*			trans	65.3	132.9	132.9	165.3	0	0	0	0	118.7
93	T	34.5	Very low	33	Very low	139 Å²	139	153.5 Å²	153.5	85%	0.853	77%	0.772	S	S	*	*			cis	-154.8	172.1	-0.9	13.4	0	0	0	0	111.5
94	E	29.7	Very low	32.6	Very low	190 Å²	190	150 Å²	150	89%	0.888	77%	0.765	S	S	*	*			trans	-132	-179.1	-165.4	-162.9	162.3	-156.4	0	0	114
95	Y	27.3	Very low	32	Very low	218 Å²	218	152.2 Å²	152.2	86%	0.855	76%	0.764	S	S	*	*			trans	-110.9	176.4	-174.8	-122.4	-99	0	0	0	111.9
96	K	32.5	Very low	31.7	Very low	191 Å²	191	152.5 Å²	152.5	83%	0.83	76%	0.76	S	S	*	*			trans	71.6	165.8	167.3	-69.5	-167.9	174.3	-169.9	0	118.2
97	N	25	Very low	31.6	Very low	109 Å²	109	157.5 Å²	157.5	58%	0.583	77%	0.77	S	S	*	*			cis	-175.5	152.9	-38.5	-162.7	28.6	0	0	0	109.1
98	E	31	Very low	31.5	Very low	161 Å²	161	161.5 Å²	161.5	75%	0.752	77%	0.768	S	S	*	*			trans	60	158.9	161.5	-83	143.4	-154.6	0	0	117.9
99	E	30	Very low	31.2	Very low	154 Å²	154	160.1 Å²	160.1	72%	0.72	77%	0.769	S	S	*	*			cis	-156.2	151.3	-17.4	-175.7	175.6	-162.2	0	0	110.9
100	Y	29.6	Very low	31.2	Very low	178 Å²	178	164.3 Å²	164.3	70%	0.698	77%	0.774	S	S	*	*			trans	58.6	130.6	158.3	-89.9	-143.7	0	0	0	125.2
101	Q	28.9	Very low	30.6	Very low	115 Å²	115	159.3 Å²	159.3	54%	0.537	77%	0.771	S	S	.	*				41.3	123	127	-62.4	-167.3	33	0	0	118.8
102	R	27.4	Very low	30.6	Very low	217 Å²	217	159.8 Å²	159.8	82%	0.819	77%	0.766	S	S	*	*			cis	-169.7	173.8	41	-101.1	150.8	-157.4	-155.2	7.4	108.3
103	S	28.3	Very low	30.5	Very low	100 Å²	100	165.7 Å²	165.7	70%	0.699	77%	0.774	S	S	*	*			cis	-172.5	176	-7.7	45.9	0	0	0	0	110.7
104	E	29.1	Very low	30.6	Very low	138 Å²	138	166.9 Å²	166.9	65%	0.645	77%	0.768	S	S	*	*			trans	78.7	137.8	153.7	-88.4	-76.4	66.6	0	0	122.5
105	R	28.8	Very low	30.8	Very low	197 Å²	197	165 Å²	165	74%	0.743	76%	0.762	S	S	*	*			trans	76.9	105	151.4	-74.3	175.1	-162.9	-155.5	-0.3	124.6
106	N	27	Very low	30.9	Very low	141 Å²	141	165 Å²	165	75%	0.754	76%	0.761	S	S	*	*				57.2	104.3	112.1	-82.7	-31.8	0	0	0	120.5
107	K	31.6	Very low	30.9	Very low	205 Å²	205	162.8 Å²	162.8	89%	0.891	76%	0.757	S	S	*	*				-173.9	150.9	91.2	-101.5	162.6	-177.1	174.7	0	113.5
108	R	33.9	Very low	31.1	Very low	233 Å²	233	162.4 Å²	162.4	88%	0.879	76%	0.763	S	S	*	*			trans	-79.5	155.6	161.2	-63.7	179.4	177.5	-178.8	-1.7	110
109	L	31.2	Very low	31.1	Very low	174 Å²	174	159.4 Å²	159.4	91%	0.911	76%	0.76	S	S	*	*				-177.1	139.9	118	-98.5	171.4	0	0	0	111.8
110	D	32.5	Very low	31.3	Very low	161 Å²	161	157 Å²	157	86%	0.861	76%	0.76	S	S	*	*			trans	-82.8	145.6	172.6	-76.3	-85.4	0	0	0	112.6
111	A	32.2	Very low	31.4	Very low	98 Å²	98	153.1 Å²	153.1	81%	0.81	77%	0.765	S	S	*	*			trans	-157.2	71.7	167.2	0	0	0	0	0	113.8
112	D	35.4	Very low	31.5	Very low	108 Å²	108	153.3 Å²	153.3	58%	0.578	78%	0.779	S	S	*	*			trans	23.1	123.3	145.5	-161.1	8.5	0	0	0	120.9	K114	D112-K114 WeakPolarHBondContact OD1-CG 3.45Å; D112-K114 PolarHBondContact OD1-N 3.48Å; D112-K114 VanDerWaalsContact OD2-CE 3.31Å; D112-K114 WeakPolarHBondContact OD2-CE 3.3Å; D112-K114 IonicContact OD2-NZ 3.65Å; D112-K114 PolarHBondContact OD2-NZ 3.32Å
113	R	35.5	Very low	31.7	Very low	252 Å²	252	154.4 Å²	154.4	95%	0.951	78%	0.783	S	S	*	*			trans	-133.8	100.3	153	-91.6	-163.9	176.5	-167.2	1.4	111.9
114	K	34.8	Very low	31.9	Very low	164 Å²	164	158.1 Å²	158.1	71%	0.713	79%	0.789	S	S	*	*			trans	-73.5	150.2	171.5	-64	170.2	175.6	116.6	0	112.7	D112	D112-K114 WeakPolarHBondContact OD1-CG 3.45Å; D112-K114 PolarHBondContact OD1-N 3.48Å; D112-K114 VanDerWaalsContact OD2-CE 3.31Å; D112-K114 WeakPolarHBondContact OD2-CE 3.3Å; D112-K114 IonicContact OD2-NZ 3.65Å; D112-K114 PolarHBondContact OD2-NZ 3.32Å
115	I	34.5	Very low	32.8	Very low	152 Å²	152	156.4 Å²	156.4	78%	0.779	79%	0.79	S	S	*	*			trans	-153.1	111.9	133.8	-101.2	148.8	0	0	0	109.9
116	R	29.9	Very low	32.7	Very low	217 Å²	217	156.9 Å²	156.9	82%	0.819	79%	0.793	S	S	*	*			trans	46.1	145.2	143.8	-51.6	178.9	-178.5	173.1	-0	121.9
117	L	31.4	Very low	33	Very low	144 Å²	144	158.6 Å²	158.6	75%	0.754	79%	0.794	S	S	*	*			cis	-166.5	144.5	-16.7	-107.6	172.7	0	0	0	108.2
118	S	29.9	Very low	32.8	Very low	102 Å²	102	155.7 Å²	155.7	71%	0.713	79%	0.788	S	S	*	*			trans	21	151.7	145	-52.3	0	0	0	0	123.8
119	S	31.9	Very low	32.7	Very low	98 Å²	98	152.7 Å²	152.7	69%	0.685	78%	0.784	S	S	*	*			cis	-178.2	153.2	-18.3	53.2	0	0	0	0	112.1
120	S	32.4	Very low	33.8	Very low	104 Å²	104	149 Å²	149	73%	0.727	77%	0.771	S	S	*	*			trans	57.7	121.1	141.8	64.5	0	0	0	0	123.8
121	A	33.3	Very low	33.6	Very low	96 Å²	96	148 Å²	148	79%	0.793	76%	0.761	S	S	*	*				85.6	105.7	126.1	0	0	0	0	0	123.6
122	S	31.2	Very low	33.7	Very low	118 Å²	118	150.5 Å²	150.5	83%	0.825	75%	0.754	S	S	*	*				81	143.1	124.8	-151.5	0	0	0	0	122.9
123	R	30.2	Very low	33.4	Very low	241 Å²	241	151 Å²	151	91%	0.909	76%	0.761	S	S	*	*			trans	79.3	135.3	166.5	-84.2	-172.8	169.6	-175	-3.2	122.4
124	E	32.4	Very low	33.1	Very low	178 Å²	178	144.1 Å²	144.1	83%	0.832	75%	0.75	S	S	*	*			trans	-69.9	178.1	162.6	-67.5	178.7	124.3	0	0	113.6
125	P	49	Very low	32.9	Very low	102 Å²	102	142 Å²	142	66%	0.662	75%	0.751	S	S	*	*			cis	-139.4	-179.9	-35.1	35.5	-17.4	0	0	0	115.2
126	Y	26.7	Very low	32.9	Very low	207 Å²	207	145 Å²	145	81%	0.812	75%	0.752	S	S	*	*			trans	74.8	127.5	149.2	-93.8	-64.2	0	0	0	123.6
127	K	32	Very low	33.2	Very low	176 Å²	176	142.1 Å²	142.1	77%	0.765	75%	0.745	S	S	*	*			trans	69.9	98.4	147.3	-90.7	165.9	-176.1	178.8	0	122
128	N	27.8	Very low	33.3	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	75%	0.745	S	S	*	*				44.1	115.3	125.2	-65.5	-3.8	0	0	0	123
129	Q	32.4	Very low	33.7	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	75%	0.747	S	S	*	*				70.3	155.7	129.8	-61	-77.9	41.7	0	0	118.6
130	P	53.4	Low	34.7	Very low	98 Å²	98	148 Å²	148	64%	0.636	75%	0.754	S	S	*	*				-137	-171.3	-70.9	31.9	-10.1	0	0	0	114.5
131	E	29.6	Very low	35.4	Very low	139 Å²	139	152.2 Å²	152.2	65%	0.65	76%	0.762	S	S	*	*			trans	118.3	114.4	144.8	-58.7	-126.9	113.6	0	0	120.1
132	K	33.3	Very low	35.5	Very low	151 Å²	151	159.5 Å²	159.5	66%	0.657	77%	0.769	S	S	*	*				81	104.7	128.9	-70.2	174.3	-178.8	149.5	0	122.9
133	T	29.9	Very low	35.6	Very low	119 Å²	119	165.4 Å²	165.4	73%	0.73	77%	0.773	S	S	*	*				83.2	111	120.6	56.7	0	0	0	0	124
134	C	28.5	Very low	35.8	Very low	106 Å²	106	158.6 Å²	158.6	72%	0.716	77%	0.769	S	S	*	*				96.4	131.8	114.6	-73.7	0	0	0	0	123.9
135	V	32.2	Very low	35.7	Very low	121 Å²	121	159.7 Å²	159.7	73%	0.733	77%	0.771	S	S	*	*			trans	63.5	152	144.3	-58.9	0	0	0	0	121.6
136	R	33.1	Very low	35	Very low	215 Å²	215	159.1 Å²	159.1	81%	0.811	77%	0.769	S	S	*	*			cis	-171.3	155.8	-25.7	-109.3	172.2	172.9	164.5	-2.9	111.5
137	K	36.8	Very low	36.4	Very low	155 Å²	155	155 Å²	155	67%	0.674	77%	0.768	S	S	*	*			trans	83.1	130.5	142.5	-82.8	178.2	176.2	-177.9	0	124.5
138	R	33.4	Very low	36.5	Very low	198 Å²	198	152.9 Å²	152.9	75%	0.747	77%	0.77	S	S	*	*			trans	86.5	113.2	133.8	-75.9	176.4	176.8	175.6	-4.7	123.7
139	D	37.3	Very low	37.9	Very low	142 Å²	142	151.6 Å²	151.6	76%	0.759	77%	0.769	S	S	*	*				44.5	142.2	105	-55.6	-52.8	0	0	0	120.6
140	P	53.5	Low	37.6	Very low	129 Å²	129	151.6 Å²	151.6	84%	0.838	78%	0.775	S	S	*	*				-150.1	-172.7	56.1	42.3	-21	0	0	0	119.2
141	E	46.8	Very low	36.5	Very low	191 Å²	191	149.4 Å²	149.4	89%	0.893	77%	0.77	S	S	*	*			trans	-95.3	170.3	-170.5	-45.2	170.5	101.3	0	0	117.2
142	R	35	Very low	36.7	Very low	249 Å²	249	148.9 Å²	148.9	94%	0.94	78%	0.782	S	S	*	*			trans	-161.2	161.2	140.2	-119.1	175.9	-174.9	-92.1	-1.3	114.5
143	R	33.5	Very low	36.5	Very low	242 Å²	242	148.6 Å²	148.6	91%	0.913	78%	0.783	S	S	*	*			trans	-143.5	149.1	-168.6	177	-178.4	175.3	-158	-0.2	115.2
144	A	34.6	Very low	36.6	Very low	98 Å²	98	152.7 Å²	152.7	81%	0.81	79%	0.785	S	S	*	*			trans	-166.2	163.1	169.3	0	0	0	0	0	109.3
145	K	30.5	Very low	36.7	Very low	202 Å²	202	155.4 Å²	155.4	88%	0.878	79%	0.79	S	S	*	*			cis	-155.9	-161.3	-26.8	-154.4	-154	174.7	-171.2	0	108.3
146	S	33.7	Very low	36.6	Very low	89 Å²	89	153.1 Å²	153.1	62%	0.622	79%	0.791	S	S	*	*			trans	-157.5	172.4	176.1	60.7	0	0	0	0	110.9
147	P	57.2	Low	36.4	Very low	122 Å²	122	150.7 Å²	150.7	79%	0.792	79%	0.793	S	S	*	*				-150.1	-156.4	80.8	41.4	-19.5	0	0	0	116.8
148	T	34.5	Very low	36	Very low	131 Å²	131	151.4 Å²	151.4	80%	0.804	80%	0.799	S	S	*	*			trans	-120.2	-158	-163.9	55	0	0	0	0	112.6
149	P	55.7	Low	36	Very low	117 Å²	117	147.4 Å²	147.4	76%	0.76	80%	0.796	S	S	*	*			cis	-142.7	-163.9	-5.1	42.9	-20.8	0	0	0	117.8
150	D	27.6	Very low	35.7	Very low	170 Å²	170	145.9 Å²	145.9	91%	0.909	79%	0.789	S	S	*	*			trans	79.3	147.2	154.6	-132.7	27.7	0	0	0	120.4
151	G	29.8	Very low	34.7	Very low	51 Å²	51	149.2 Å²	149.2	53%	0.526	78%	0.784	S	S	.	*			cis	-178.4	156.9	-6.3	0	0	0	0	0	115.2
152	S	33	Very low	34	Very low	129 Å²	129	151.7 Å²	151.7	90%	0.902	79%	0.785	S	S	*	*			trans	51.8	175.8	162.4	69.3	0	0	0	0	123.1
153	E	30.7	Very low	33.9	Very low	145 Å²	145	144 Å²	144	68%	0.678	78%	0.775	S	S	*	*				-166.9	171.8	-65.4	-154.3	-171	-118.2	0	0	110.7
154	R	31.6	Very low	33.9	Very low	204 Å²	204	136.1 Å²	136.1	77%	0.77	76%	0.757	S	S	*	*			trans	85.6	121	164.4	-50	-153.8	168	-163.3	-5.8	117.2
155	I	30.7	Very low	34	Very low	164 Å²	164	142.6 Å²	142.6	84%	0.841	76%	0.761	S	S	*	*				91.7	120.5	54.7	-70.1	160.2	0	0	0	112.5
156	G	28.6	Very low	34.1	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	75%	0.753	S	S	*	*			trans	178.8	124.7	168.9	0	0	0	0	0	111
157	L	30.6	Very low	34.1	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	76%	0.758	S	S	*	*			trans	-140.5	138.7	-179	-103.8	174.1	0	0	0	109.2
158	E	28.5	Very low	33	Very low	170 Å²	170	141.7 Å²	141.7	79%	0.794	76%	0.762	S	S	*	*			trans	66	160.8	155.7	-115.3	165.5	-159.6	0	0	116.1
159	V	31.6	Very low	33	Very low	114 Å²	114	140.6 Å²	140.6	69%	0.691	76%	0.76	S	S	*	*			cis	-145.8	159.2	7.8	-160.2	0	0	0	0	110.2
160	D	32.7	Very low	32.3	Very low	111 Å²	111	139.4 Å²	139.4	59%	0.594	75%	0.754	S	S	*	*				109.5	146.6	128.2	-127.3	-13.5	0	0	0	124.1
161	R	32.6	Very low	32.3	Very low	199 Å²	199	141.7 Å²	141.7	75%	0.751	76%	0.756	S	S	*	*			trans	73.7	91.2	155.2	-76.9	154.7	-138.9	-162.7	10	124
162	R	32.2	Very low	32.8	Very low	242 Å²	242	146.4 Å²	146.4	91%	0.913	76%	0.764	S	S	*	*				54.8	122.9	114.9	-68.8	-174.7	176.7	-156.7	-2	122.4
163	A	32.9	Very low	32.9	Very low	87 Å²	87	147.6 Å²	147.6	72%	0.719	76%	0.756	S	S	*	*				119.6	132.6	122.7	0	0	0	0	0	120.7
164	S	32.9	Very low	33	Very low	77 Å²	77	147.1 Å²	147.1	54%	0.538	76%	0.762	S	S	.	*			trans	74.5	106.5	147.5	-61.2	0	0	0	0	123.2
165	R	35.5	Very low	32.9	Very low	234 Å²	234	144.9 Å²	144.9	88%	0.883	77%	0.766	S	S	*	*				52	124.3	127	-85.9	-177.6	167.2	166.1	-4.7	122.6
166	S	33.6	Very low	33	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	76%	0.761	S	S	*	*			trans	40.3	148.9	134.1	59.8	0	0	0	0	122.5
167	S	34.7	Very low	33.3	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	77%	0.765	S	S	*	*			cis	-174.8	155.7	-10.8	-88.3	0	0	0	0	108.2
168	Q	32.8	Very low	33.5	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.874	76%	0.762	S	S	*	*			trans	65.4	135.6	174.3	-72.2	167.1	-37.2	0	0	114.8
169	S	34.1	Very low	33.7	Very low	109 Å²	109	149.7 Å²	149.7	76%	0.762	76%	0.764	S	S	*	*				68.8	133	76.5	-140	0	0	0	0	112.7
170	S	42	Very low	33.8	Very low	91 Å²	91	147.1 Å²	147.1	64%	0.636	76%	0.761	S	S	*	*			cis	-140.6	175.8	5.9	-52.8	0	0	0	0	110.1
171	K	27.7	Very low	33.8	Very low	218 Å²	218	147.1 Å²	147.1	95%	0.948	77%	0.77	S	S	*	*			trans	-148	136.6	151.4	-146.6	153.6	-168.3	163.9	0	112.3
172	E	40.5	Very low	34.1	Very low	150 Å²	150	144.6 Å²	144.6	70%	0.701	77%	0.772	S	S	*	*			trans	-161	-178.1	-147.6	-157.8	172.1	-145.3	0	0	109
173	E	34.8	Very low	34.2	Very low	155 Å²	155	141.1 Å²	141.1	72%	0.724	77%	0.765	S	S	*	*			trans	68.7	151.3	160	-65.4	-54.8	89.1	0	0	122.2
174	V	31.6	Very low	34.2	Very low	135 Å²	135	144.9 Å²	144.9	82%	0.818	77%	0.768	S	S	*	*			trans	-123.7	84.7	164.5	-82.8	0	0	0	0	110.4
175	N	30.5	Very low	34.4	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	78%	0.78	S	S	*	*			trans	56	123.3	158.6	-77.9	6.4	0	0	0	120.8
176	S	33.2	Very low	34.2	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	77%	0.771	S	S	*	*				-150.4	116.2	109.1	57.8	0	0	0	0	113.6
177	E	34.6	Very low	34.4	Very low	180 Å²	180	139 Å²	139	84%	0.841	77%	0.768	S	S	*	*			trans	73	86.3	140.5	-63.6	169.9	-142.6	0	0	122.6
178	E	35.3	Very low	34.3	Very low	168 Å²	168	139 Å²	139	79%	0.785	77%	0.767	S	S	*	*				67	142.4	128.9	-114.5	176.5	118.8	0	0	126.3
179	Y	32	Very low	34.3	Very low	216 Å²	216	133.7 Å²	133.7	85%	0.847	76%	0.763	S	S	*	*			trans	61.2	131.8	168.8	-85.5	-92.6	0	0	0	120.3
180	G	33.1	Very low	34.3	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	77%	0.767	S	S	*	*			cis	163.6	144.2	-13.9	0	0	0	0	0	115.3
181	S	34.1	Very low	33.8	Very low	112 Å²	112	134.1 Å²	134.1	78%	0.783	77%	0.766	S	S	*	*			trans	65.7	155.7	166.9	66.3	0	0	0	0	120.4
182	D	38	Very low	34	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	76%	0.76	S	S	*	*			cis	-169.5	166.5	-27.1	-96.4	-44.4	0	0	0	112.5
183	H	33.6	Very low	33.6	Very low	169 Å²	169	131.3 Å²	131.3	78%	0.782	76%	0.761	S	S	*	*			trans	61.5	126.5	163.7	93.1	-37.4	0	0	0	121.2
184	E	33.7	Very low	33.4	Very low	166 Å²	166	132.5 Å²	132.5	78%	0.776	77%	0.767	S	S	*	*				68.4	146.8	83	-65.3	-154.4	85.6	0	0	116.8
185	T	36.5	Very low	33.3	Very low	130 Å²	130	129.5 Å²	129.5	80%	0.798	76%	0.763	S	S	*	*			cis	-161.7	-179.3	-7.1	20.5	0	0	0	0	108.6
186	G	32.1	Very low	33.2	Very low	67 Å²	67	129 Å²	129	69%	0.691	76%	0.761	S	S	*	*			cis	157.8	142.3	-6.2	0	0	0	0	0	114.3
187	S	37.3	Very low	32.9	Very low	94 Å²	94	130.1 Å²	130.1	66%	0.657	76%	0.758	S	S	*	*			trans	65.1	168.8	170.5	-82.1	0	0	0	0	120.2
188	S	33.8	Very low	32.8	Very low	102 Å²	102	127.1 Å²	127.1	71%	0.713	75%	0.753	S	S	*	*			cis	-177.7	147.9	-34.6	62.1	0	0	0	0	112.9
189	G	31.2	Very low	32.6	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	76%	0.756	S	S	*	*			trans	124.8	138.4	169.5	0	0	0	0	0	113.6
190	S	33.8	Very low	32.5	Very low	119 Å²	119	123.9 Å²	123.9	83%	0.832	75%	0.749	S	S	*	*			cis	82.2	128.1	27.1	-151.8	0	0	0	0	113.7
191	S	33.2	Very low	32.6	Very low	90 Å²	90	127.8 Å²	127.8	63%	0.629	75%	0.752	S	S	*	*			cis	-175.6	149.1	-5.1	37.8	0	0	0	0	113
192	D	30.6	Very low	32.7	Very low	151 Å²	151	130.3 Å²	130.3	81%	0.807	75%	0.751	S	S	*	*			trans	68.5	154.1	149.3	-57	-38.3	0	0	0	124.8
193	E	32.7	Very low	32.5	Very low	158 Å²	158	131.7 Å²	131.7	74%	0.738	75%	0.753	S	S	*	*			trans	81.8	107.3	157.4	-57.2	-143.4	97.8	0	0	124.4
194	Q	30.7	Very low	32.4	Very low	180 Å²	180	126.7 Å²	126.7	84%	0.841	75%	0.747	S	S	*	*			trans	66.8	132.8	130.8	-56	-170.5	34.6	0	0	123.3
195	G	29.3	Very low	32.4	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	75%	0.745	S	S	*	*			trans	139.1	91.5	166	0	0	0	0	0	112.5
196	N	28.7	Very low	32.3	Very low	148 Å²	148	126.1 Å²	126.1	79%	0.791	74%	0.743	S	S	*	*				64.6	124.2	84.7	-85.1	3.5	0	0	0	117
197	N	26.8	Very low	32.3	Very low	129 Å²	129	131.3 Å²	131.3	69%	0.69	75%	0.749	S	S	*	*			trans	62.5	105.5	143.6	-58.6	3.4	0	0	0	118.1
198	T	33.1	Very low	32.1	Very low	117 Å²	117	133.8 Å²	133.8	72%	0.718	76%	0.755	S	S	*	*				68.5	114.2	77.2	62.3	0	0	0	0	116
199	E	30.6	Very low	32.1	Very low	181 Å²	181	134.1 Å²	134.1	85%	0.846	75%	0.753	S	S	*	*			trans	171.1	128.9	139.6	-93.8	152.7	-150.1	0	0	107.8
200	N	30.3	Very low	32.2	Very low	134 Å²	134	138.3 Å²	138.3	72%	0.717	75%	0.752	S	S	*	*				61.5	142.4	107.4	-92.8	26	0	0	0	114.9
201	E	35.6	Very low	32.3	Very low	143 Å²	143	141 Å²	141	67%	0.668	75%	0.751	S	S	*	*			cis	-163	162.6	32.9	-126.3	136.9	-133.2	0	0	112.1
202	E	35.8	Very low	32.3	Very low	164 Å²	164	144.4 Å²	144.4	77%	0.766	76%	0.762	S	S	*	*			trans	59.1	153.8	146.2	-73.3	173.2	-172.8	0	0	121.8
203	E	33.7	Very low	32.6	Very low	176 Å²	176	145 Å²	145	82%	0.822	76%	0.76	S	S	*	*			cis	-156.5	172.8	-10.8	-137	-173.9	-167.5	0	0	111.3
204	G	32	Very low	32.8	Very low	64 Å²	64	147.3 Å²	147.3	66%	0.66	77%	0.771	S	S	*	*			trans	116.3	118.6	170.2	0	0	0	0	0	114.2
205	V	32.7	Very low	33.1	Very low	120 Å²	120	143.8 Å²	143.8	73%	0.727	76%	0.762	S	S	*	*			cis	76.1	120.9	33.3	-173.8	0	0	0	0	112.5
206	E	34.4	Very low	33.5	Very low	163 Å²	163	149.2 Å²	149.2	76%	0.762	77%	0.768	S	S	*	*			cis	-160.6	179.5	-15.2	-123.4	174.6	-96	0	0	108.4
207	E	32.9	Very low	33.8	Very low	177 Å²	177	150.5 Å²	150.5	83%	0.827	77%	0.769	S	S	*	*			trans	66.3	155.5	172.3	-62.8	169.8	165.3	0	0	115.3
208	D	31.7	Very low	34.2	Very low	145 Å²	145	152 Å²	152	78%	0.775	78%	0.777	S	S	*	*			cis	-144.3	-172.5	0.6	-146.6	-19.3	0	0	0	112.2
209	V	34	Very low	34.5	Very low	110 Å²	110	151 Å²	151	67%	0.667	78%	0.781	S	S	*	*			trans	-90.7	144.7	-175.9	-175.8	0	0	0	0	113.2
210	E	34.2	Very low	34.7	Very low	164 Å²	164	150.9 Å²	150.9	77%	0.766	78%	0.78	S	S	*	*				169.7	170.5	125.4	-87	-55.1	161.4	0	0	112.1
211	E	36.2	Very low	34.9	Very low	174 Å²	174	153.3 Å²	153.3	81%	0.813	79%	0.787	S	S	*	*			trans	-79.2	143.9	-179.3	-54.5	177	150.5	0	0	112.5
212	D	32.6	Very low	34.9	Very low	162 Å²	162	153.5 Å²	153.5	87%	0.866	79%	0.793	S	S	*	*			trans	-164.4	163.5	148.9	-107.8	-25.1	0	0	0	114.4
213	E	36.1	Very low	35.2	Very low	163 Å²	163	154.6 Å²	154.6	76%	0.762	80%	0.798	S	S	*	*			trans	-39.5	136.6	-165.1	-51	-174.9	139.2	0	0	120.5	V215	E213-V215 HydrophobicContact CB-CG2 4.38Å; E213-V215 PolarHBondContact O-N 2.69Å
214	E	36.6	Very low	35.6	Very low	207 Å²	207	154.6 Å²	154.6	97%	0.967	80%	0.798	S	S	*	*			trans	-78.4	105.5	155.7	-77.9	-175.8	173.8	0	0	109.4
215	V	38.1	Very low	36.2	Very low	107 Å²	107	156.8 Å²	156.8	65%	0.648	80%	0.798	S	S	*	*			trans	-107.9	122.5	162.7	179.8	0	0	0	0	107.8	E213	E213-V215 HydrophobicContact CB-CG2 4.38Å; E213-V215 PolarHBondContact O-N 2.69Å
216	E	38	Very low	37	Very low	185 Å²	185	157.6 Å²	157.6	86%	0.864	80%	0.799	S	S	*	*			trans	-121.8	138.6	164.7	-82.7	-74.4	-169.8	0	0	107.7
217	E	35.6	Very low	37.6	Very low	175 Å²	175	157.6 Å²	157.6	82%	0.818	80%	0.798	S	S	*	*			trans	-88.1	159.3	-158.7	-62.6	-174.9	130.2	0	0	114.1
218	D	34.8	Very low	38.3	Very low	161 Å²	161	155.9 Å²	155.9	86%	0.861	80%	0.795	S	S	*	*			trans	-63.9	136.7	179	-59.2	-69.1	0	0	0	112.5
219	A	37.9	Very low	39.1	Very low	96 Å²	96	151 Å²	151	79%	0.793	78%	0.779	S	S	*	*			trans	-133.3	85.2	164.7	0	0	0	0	0	108.6	E221	A219-E221 PolarHBondContact O-N 2.82Å
220	E	34.7	Very low	39.7	Very low	178 Å²	178	152.7 Å²	152.7	83%	0.832	78%	0.779	S	S	*	*			trans	-74.2	114.4	169.5	-62.2	-169.8	143.7	0	0	108.6
221	E	36.4	Very low	40.3	Very low	186 Å²	186	152.1 Å²	152.1	87%	0.869	78%	0.777	S	S	*	*			trans	-97.8	112.5	161.2	-72.1	-170.7	135.5	0	0	107.4	A219 E223	A219-E221 PolarHBondContact O-N 2.82Å; E221-E223 PolarHBondContact O-N 2.78Å
222	D	34	Very low	41.1	Very low	147 Å²	147	151.3 Å²	151.3	79%	0.786	77%	0.773	S	S	*	*			trans	-66.6	110.1	173.7	-67.9	-64.4	0	0	0	110	E224	D222-E224 PolarHBondContact O-N 3.37Å
223	E	43.8	Very low	42	Very low	187 Å²	187	151 Å²	151	87%	0.874	77%	0.766	S	S	*	*			trans	-78.9	93	162.7	-74.5	-165.9	157.9	0	0	109	E221 V225	E221-E223 PolarHBondContact O-N 2.78Å; E223-V225 PolarHBondContact O-N 3.05Å
224	E	40.2	Very low	42.9	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.822	76%	0.764	S	S	*	*			trans	-54.3	122.3	162.4	-64.6	-88.7	-155.7	0	0	108.6	D222	D222-E224 PolarHBondContact O-N 3.37Å
225	V	45.7	Very low	43.9	Very low	109 Å²	109	147.8 Å²	147.8	66%	0.661	75%	0.752	S	S	*	*			trans	-86.1	125	178.3	177.9	0	0	0	0	108.7	E223 E227	E223-V225 PolarHBondContact O-N 3.05Å; V225-E227 VanDerWaalsContact C-N 3.33Å; V225-E227 PolarHBondContact O-N 3.1Å
226	D	48.4	Very low	45	Very low	138 Å²	138	150.1 Å²	150.1	74%	0.738	76%	0.755	S	S	*	*			trans	-67.9	85	175.5	-70.3	-54.1	0	0	0	110.6	D228 G229	D226-D228 PolarHBondContact O-N 3.21Å; D226-D228 VanDerWaalsContact O-N 3.13Å; D226-G229 PolarHBondContact O-N 3.38Å
227	E	48	Very low	46.1	Very low	162 Å²	162	148.5 Å²	148.5	76%	0.757	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-30.2	176.9	-68.1	-175.2	139.4	0	0	112.3	V225 G229 E230	V225-E227 VanDerWaalsContact C-N 3.33Å; V225-E227 PolarHBondContact O-N 3.1Å; E227-G229 PolarHBondContact O-N 3.13Å; E227-E230 PolarHBondContact O-N 2.94Å
228	D	46.8	Very low	47.2	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	74%	0.743	S	S	*	*	H	α-helix	trans	-52.6	-21.4	173.8	-72.8	-2.7	0	0	0	113.8	D226	D226-D228 PolarHBondContact O-N 3.21Å; D226-D228 VanDerWaalsContact O-N 3.13Å
229	G	49.1	Very low	48.6	Very low	42 Å²	42	147.3 Å²	147.3	43%	0.433	74%	0.737	S	S	.	*	H	α-helix	trans	-88.8	-22.1	-177.5	0	0	0	0	0	115.6	D226 E227	D226-G229 PolarHBondContact O-N 3.38Å; E227-G229 PolarHBondContact O-N 3.13Å
230	E	47.5	Very low	49.9	Very low	145 Å²	145	148 Å²	148	68%	0.678	72%	0.724	S	S	*	*	H	α-helix	trans	-84.9	-31.1	179.7	-62.7	-167.4	156.7	0	0	111.3	E227 E232 E233 E234	E227-E230 PolarHBondContact O-N 2.94Å; E230-E232 PolarHBondContact O-N 2.7Å; E230-E233 PolarHBondContact O-N 3.45Å; E230-E234 PolarHBondContact O-N 3.07Å; E230-E234 VanDerWaalsContact O-N 3.1Å
231	E	46.2	Very low	51.4	Low	153 Å²	153	146.9 Å²	146.9	72%	0.715	72%	0.719	S	S	*	*	H	α-helix	trans	-65.7	-33.3	174.5	-65.6	-165	162.1	0	0	113.1	E235	E231-E235 PolarHBondContact O-N 2.9Å; E231-E235 VanDerWaalsContact O-N 3.11Å
232	E	52.1	Low	52.7	Low	156 Å²	156	142.3 Å²	142.3	73%	0.729	70%	0.697	S	S	*	*	H	α-helix	trans	-72.2	-27.6	175	-77.2	-162.4	168.2	0	0	113.1	E230 E236	E230-E232 PolarHBondContact O-N 2.7Å; E232-E236 PolarHBondContact O-N 3.4Å
233	E	53	Low	54.2	Low	156 Å²	156	141 Å²	141	73%	0.729	69%	0.687	S	S	*	*	H	α-helix	trans	-80.9	-32.1	173.7	-70.4	-159.8	171	0	0	112.2	E230 E236 E237	E230-E233 PolarHBondContact O-N 3.45Å; E233-E236 PolarHBondContact O-N 3.38Å; E233-E237 PolarHBondContact O-N 3.08Å; E233-E237 VanDerWaalsContact O-N 3.12Å
234	E	54.4	Low	55.3	Low	150 Å²	150	139.5 Å²	139.5	70%	0.701	68%	0.679	S	S	*	*	H	α-helix	trans	-68.2	-36.3	171	-71.5	-161.3	163.2	0	0	112.6	E230 E237 E238	E230-E234 PolarHBondContact O-N 3.07Å; E230-E234 VanDerWaalsContact O-N 3.1Å; E234-E237 PolarHBondContact O-N 3.39Å; E234-E238 PolarHBondContact O-N 2.88Å
235	E	57.2	Low	56.4	Low	153 Å²	153	138.3 Å²	138.3	72%	0.715	67%	0.674	S	S	*	*	H	α-helix	trans	-67.2	-33.1	172.4	-76.8	-159.7	165.1	0	0	112.9	E231 E239	E231-E235 PolarHBondContact O-N 2.9Å; E231-E235 VanDerWaalsContact O-N 3.11Å; E235-E239 PolarHBondContact O-N 3.04Å
236	E	60.9	Low	57.5	Low	155 Å²	155	140.2 Å²	140.2	72%	0.724	68%	0.676	S	S	*	*	H	α-helix	trans	-71.7	-30.6	172.7	-79.6	-155.9	170	0	0	112.9	E232 E233 E240	E232-E236 PolarHBondContact O-N 3.4Å; E233-E236 PolarHBondContact O-N 3.38Å; E236-E240 PolarHBondContact O-N 2.98Å; E236-E240 VanDerWaalsContact O-N 3.12Å
237	E	61.9	Low	58.3	Low	152 Å²	152	137.5 Å²	137.5	71%	0.71	66%	0.658	S	S	*	*	H	α-helix	trans	-74.3	-38.1	173.5	-70.1	-155.3	156.1	0	0	112.7	E233 E234 E239 E240 E241	E233-E237 PolarHBondContact O-N 3.08Å; E233-E237 VanDerWaalsContact O-N 3.12Å; E234-E237 PolarHBondContact O-N 3.39Å; E237-E239 VanDerWaalsContact C-N 3.32Å; E237-E239 PolarHBondContact O-N 3.43Å; E237-E240 PolarHBondContact O-N 3.02Å; E237-E241 PolarHBondContact O-N 3.25Å
238	E	58.2	Low	59.4	Low	155 Å²	155	137 Å²	137	72%	0.724	66%	0.656	S	S	*	*	H	α-helix	trans	-64.6	-32	171.7	-76.4	-157.3	168.1	0	0	112.5	E234 E242	E234-E238 PolarHBondContact O-N 2.88Å; E238-E242 PolarHBondContact O-N 3.31Å; E238-E242 VanDerWaalsContact O-N 3.14Å
239	E	64.9	Low	60.1	Low	155 Å²	155	137.4 Å²	137.4	72%	0.724	65%	0.653	S	S	*	*	H	α-helix	trans	-74.2	-34.3	172.5	-76.4	-155.9	163.4	0	0	113.8	E235 E237 E243	E235-E239 PolarHBondContact O-N 3.04Å; E237-E239 VanDerWaalsContact C-N 3.32Å; E237-E239 PolarHBondContact O-N 3.43Å; E239-E243 PolarHBondContact O-N 3.13Å
240	E	64.6	Low	61.3	Low	110 Å²	110	142 Å²	142	51%	0.514	66%	0.664	S	S	.	*	H	α-helix	trans	-69.1	-32.6	170.8	-80.6	-153.1	166.7	0	0	111.6	E236 E237 E244 K445	E236-E240 PolarHBondContact O-N 2.98Å; E236-E240 VanDerWaalsContact O-N 3.12Å; E237-E240 PolarHBondContact O-N 3.02Å; E240-E244 PolarHBondContact O-N 3.41Å; E240-K445 IonicContact OE2-NZ 2.86Å; E240-K445 PolarHBondContact OE2-NZ 3.2Å
241	E	65.1	Low	62.1	Low	156 Å²	156	141.5 Å²	141.5	73%	0.729	66%	0.657	S	S	*	*	H	α-helix	trans	-70.9	-41.3	174.7	-73.6	-156	160.2	0	0	113.3	E237 E243 E244 E245	E237-E241 PolarHBondContact O-N 3.25Å; E241-E243 PolarHBondContact O-N 2.92Å; E241-E244 PolarHBondContact O-N 2.91Å; E241-E245 PolarHBondContact O-N 3.34Å
242	E	64.8	Low	63.2	Low	89 Å²	89	141.5 Å²	141.5	42%	0.416	66%	0.657	S	S	.	*	H	α-helix	trans	-66.9	-31	174.2	-82	-154.7	169.1	0	0	113.1	E238 E246 R583	E238-E242 PolarHBondContact O-N 3.31Å; E238-E242 VanDerWaalsContact O-N 3.14Å; E242-E246 PolarHBondContact O-N 3.32Å; E242-E246 VanDerWaalsContact O-N 3.12Å; E242-R583 IonicContact OE1-CZ 2.88Å; E242-R583 VanDerWaalsContact OE1-CZ 3.23Å; E242-R583 IonicContact OE1-NH1 2.61Å; E242-R583 PolarHBondContact OE1-NH1 3.1Å; E242-R583 IonicContact OE1-NH2 2.73Å; E242-R583 IonicContact OE2-CZ 3.19Å; E242-R583 IonicContact OE2-NH1 3.09Å; E242-R583 PolarHBondContact OE2-NH1 3.31Å; E242-R583 IonicContact OE2-NH2 3.73Å; E242-R583 PolarHBondContact OE2-NH2 3.47Å
243	E	65.5	Low	63.6	Low	121 Å²	121	140 Å²	140	57%	0.565	65%	0.65	S	S	*	*	H	α-helix	trans	-69.3	-30.2	172.3	-83.3	-153	162	0	0	112.7	E239 E241 E247 H510	E239-E243 PolarHBondContact O-N 3.13Å; E241-E243 PolarHBondContact O-N 2.92Å; E243-E247 PolarHBondContact O-N 3.17Å; E243-E247 VanDerWaalsContact O-N 3.1Å; E243-H510 IonicContact OE1-CE1 3.27Å
244	E	66.3	Low	64.1	Low	155 Å²	155	137.3 Å²	137.3	72%	0.724	64%	0.64	S	S	*	*	H	α-helix	trans	-74.6	-36.1	174.5	-69.8	-155.3	161.4	0	0	112.5	E240 E241 E247 E248	E240-E244 PolarHBondContact O-N 3.41Å; E241-E244 PolarHBondContact O-N 2.91Å; E244-E247 PolarHBondContact O-N 3.28Å; E244-E248 PolarHBondContact O-N 3.12Å; E244-E248 VanDerWaalsContact O-N 3.16Å
245	E	63.4	Low	64.7	Low	150 Å²	150	135.8 Å²	135.8	70%	0.701	63%	0.633	S	S	*	*	H	α-helix	trans	-65.1	-38.9	170.6	-73.9	-157.3	156.1	0	0	112.4	E241 E248 E249	E241-E245 PolarHBondContact O-N 3.34Å; E245-E248 PolarHBondContact O-N 3.29Å; E245-E249 PolarHBondContact O-N 2.8Å; E245-E249 VanDerWaalsContact O-N 3.16Å
246	E	68.4	Low	64.8	Low	150 Å²	150	135.7 Å²	135.7	70%	0.701	63%	0.626	S	S	*	*	H	α-helix	trans	-69.6	-33.9	175.5	-76.6	-158.4	175.6	0	0	113.3	E242 E250	E242-E246 PolarHBondContact O-N 3.32Å; E242-E246 VanDerWaalsContact O-N 3.12Å; E246-E250 PolarHBondContact O-N 3.43Å
247	E	66.1	Low	64.8	Low	80 Å²	80	132.8 Å²	132.8	37%	0.374	62%	0.615	S	S	.	*	H	α-helix	trans	-65.1	-41.1	171	-93.6	-156.2	-147.7	0	0	110.8	E243 E244 E250 Y251 K507	E243-E247 PolarHBondContact O-N 3.17Å; E243-E247 VanDerWaalsContact O-N 3.1Å; E244-E247 PolarHBondContact O-N 3.28Å; E247-E250 PolarHBondContact O-N 3.3Å; E247-Y251 HydrophobicContact CB-CE2 4.12Å; E247-Y251 WeakPolarHBondContact O-CD2 3.18Å; E247-Y251 PolarHBondContact O-N 3.18Å; E247-Y251 VanDerWaalsContact O-N 3.17Å; E247-Y251 WeakPolarHBondContact OE2-CE2 3.48Å; E247-Y251 PolarHBondContact OE2-OH 3.14Å; E247-K507 IonicContact OE1-NZ 2.7Å; E247-K507 PolarHBondContact OE1-NZ 3.43Å
248	E	70.1	Confident	64.5	Low	152 Å²	152	132.5 Å²	132.5	71%	0.71	61%	0.614	S	S	*	*	H	α-helix	trans	-65.7	-40.3	178.6	-72.1	-149	152.3	0	0	113.6	E244 E245 E250 Y251 E252	E244-E248 PolarHBondContact O-N 3.12Å; E244-E248 VanDerWaalsContact O-N 3.16Å; E245-E248 PolarHBondContact O-N 3.29Å; E248-E250 VanDerWaalsContact C-N 3.34Å; E248-E250 PolarHBondContact O-N 2.78Å; E248-Y251 PolarHBondContact O-N 3.28Å; E248-E252 PolarHBondContact O-N 3.48Å; E248-E252 VanDerWaalsContact O-N 3.1Å
249	E	62.9	Low	64.2	Low	150 Å²	150	131.4 Å²	131.4	70%	0.701	61%	0.607	S	S	*	*	H	α-helix	trans	-65.1	-32.1	174.4	-79.2	-149.5	168.4	0	0	112.9	E245 Q253	E245-E249 PolarHBondContact O-N 2.8Å; E245-E249 VanDerWaalsContact O-N 3.16Å; E249-Q253 PolarHBondContact O-N 3.18Å
250	E	74.7	Confident	63.4	Low	140 Å²	140	131 Å²	131	65%	0.654	61%	0.605	S	S	*	*	H	α-helix	trans	-68	-41.2	174.4	-168.4	170.4	-149.3	0	0	111.1	E246 E247 E248 Q253 D254	E246-E250 PolarHBondContact O-N 3.43Å; E247-E250 PolarHBondContact O-N 3.3Å; E248-E250 VanDerWaalsContact C-N 3.34Å; E248-E250 PolarHBondContact O-N 2.78Å; E250-Q253 PolarHBondContact O-N 3.12Å; E250-D254 PolarHBondContact O-N 3.07Å
251	Y	63.6	Low	62.5	Low	134 Å²	134	135 Å²	135	53%	0.525	62%	0.623	S	S	.	*	H	α-helix	trans	-65.8	-39.6	176.8	-69.6	-63.6	0	0	0	113.3	E247 E248 Q253 E255	E247-Y251 HydrophobicContact CB-CE2 4.12Å; E247-Y251 WeakPolarHBondContact O-CD2 3.18Å; E247-Y251 PolarHBondContact O-N 3.18Å; E247-Y251 VanDerWaalsContact O-N 3.17Å; E247-Y251 WeakPolarHBondContact OE2-CE2 3.48Å; E247-Y251 PolarHBondContact OE2-OH 3.14Å; E248-Y251 PolarHBondContact O-N 3.28Å; Y251-Q253 PolarHBondContact O-N 3.26Å; Y251-E255 WeakPolarHBondContact O-CB 3.3Å; Y251-E255 PolarHBondContact O-N 3.1Å
252	E	69.8	Low	61.5	Low	153 Å²	153	130.2 Å²	130.2	72%	0.715	62%	0.616	S	S	*	*	H	α-helix	trans	-64.6	-29.6	173.7	-79.1	-138.1	154.2	0	0	112.6	E248 R256	E248-E252 PolarHBondContact O-N 3.48Å; E248-E252 VanDerWaalsContact O-N 3.1Å; E252-R256 PolarHBondContact O-N 3.09Å
253	Q	60.9	Low	60.6	Low	125 Å²	125	131.9 Å²	131.9	58%	0.584	63%	0.628	S	S	*	*	H	α-helix	trans	-73.8	-46.2	178.4	-153.7	149.6	130.9	0	0	111.6	E249 E250 Y251 E255 R256 D257	E249-Q253 PolarHBondContact O-N 3.18Å; E250-Q253 PolarHBondContact O-N 3.12Å; Y251-Q253 PolarHBondContact O-N 3.26Å; Q253-E255 VanDerWaalsContact C-N 3.32Å; Q253-E255 PolarHBondContact O-N 3.02Å; Q253-R256 WeakPolarHBondContact O-CB 3.47Å; Q253-R256 PolarHBondContact O-N 3.28Å; Q253-D257 PolarHBondContact O-N 2.99Å
254	D	62.4	Low	59.3	Low	99 Å²	99	134.4 Å²	134.4	53%	0.529	65%	0.646	S	S	.	*	H	α-helix	trans	-64	-33.6	175.1	-105.7	11.6	0	0	0	112.4	E250 R256 Q258	E250-D254 PolarHBondContact O-N 3.07Å; D254-R256 VanDerWaalsContact C-N 3.29Å; D254-R256 PolarHBondContact O-N 3.21Å; D254-Q258 WeakPolarHBondContact O-CG 3.5Å; D254-Q258 PolarHBondContact O-N 3.03Å; D254-Q258 PolarHBondContact O-NE2 3.43Å
255	E	67.6	Low	57.8	Low	117 Å²	117	136.6 Å²	136.6	55%	0.547	65%	0.649	S	S	.	*	H	α-helix	trans	-67.1	-27.2	171.1	-100.9	-83.5	127.7	0	0	112.5	Y251 Q253 K259	Y251-E255 WeakPolarHBondContact O-CB 3.3Å; Y251-E255 PolarHBondContact O-N 3.1Å; Q253-E255 VanDerWaalsContact C-N 3.32Å; Q253-E255 PolarHBondContact O-N 3.02Å; E255-K259 WeakPolarHBondContact O-CG 3.48Å; E255-K259 PolarHBondContact O-NZ 3Å; E255-K259 IonicContact OE2-NZ 2.7Å; E255-K259 PolarHBondContact OE2-NZ 3.46Å
256	R	58.9	Low	57	Low	152 Å²	152	136.8 Å²	136.8	57%	0.574	66%	0.655	S	S	*	*	H	α-helix	trans	-80.4	-50.5	178.1	179.1	178.6	-65.5	-138.8	1	111.8	E252 Q253 D254 Q258 K259 E260	E252-R256 PolarHBondContact O-N 3.09Å; Q253-R256 WeakPolarHBondContact O-CB 3.47Å; Q253-R256 PolarHBondContact O-N 3.28Å; D254-R256 VanDerWaalsContact C-N 3.29Å; D254-R256 PolarHBondContact O-N 3.21Å; R256-Q258 VanDerWaalsContact C-N 3.28Å; R256-Q258 PolarHBondContact O-N 3.37Å; R256-K259 WeakPolarHBondContact O-CA 3.39Å; R256-K259 WeakPolarHBondContact O-CB 3.42Å; R256-K259 PolarHBondContact O-N 3.06Å; R256-E260 PolarHBondContact O-N 3.28Å
257	D	61	Low	55.7	Low	93 Å²	93	135.3 Å²	135.3	50%	0.497	66%	0.656	S	S	.	*	H	α-helix	trans	-62.7	-37.1	-175.2	-79	16.1	0	0	0	111.3	Q253 K259 E260 E261	Q253-D257 PolarHBondContact O-N 2.99Å; D257-K259 PolarHBondContact O-N 3.02Å; D257-K259 VanDerWaalsContact O-N 3.14Å; D257-E260 PolarHBondContact O-N 3.42Å; D257-E261 PolarHBondContact O-N 3.36Å
258	Q	55.4	Low	54.4	Low	147 Å²	147	142.2 Å²	142.2	69%	0.687	68%	0.678	S	S	*	*	H	α-helix	trans	-63.5	-15.2	172.7	-75.1	176.9	92.7	0	0	114.7	D254 R256	D254-Q258 WeakPolarHBondContact O-CG 3.5Å; D254-Q258 PolarHBondContact O-N 3.03Å; D254-Q258 PolarHBondContact O-NE2 3.43Å; R256-Q258 VanDerWaalsContact C-N 3.28Å; R256-Q258 PolarHBondContact O-N 3.37Å
259	K	52.3	Low	53.2	Low	131 Å²	131	138.8 Å²	138.8	57%	0.57	67%	0.671	S	S	*	*	H	α-helix	trans	-93.2	-15.3	172.8	-64.9	-176.9	-171.1	77.1	0	113.1	E255 R256 D257	E255-K259 WeakPolarHBondContact O-CG 3.48Å; E255-K259 PolarHBondContact O-NZ 3Å; E255-K259 IonicContact OE2-NZ 2.7Å; E255-K259 PolarHBondContact OE2-NZ 3.46Å; R256-K259 WeakPolarHBondContact O-CA 3.39Å; R256-K259 WeakPolarHBondContact O-CB 3.42Å; R256-K259 PolarHBondContact O-N 3.06Å; D257-K259 PolarHBondContact O-N 3.02Å; D257-K259 VanDerWaalsContact O-N 3.14Å
260	E	47	Very low	51.9	Low	146 Å²	146	140 Å²	140	68%	0.682	68%	0.677	S	S	*	*	H	α-helix	trans	-94.4	-27.6	-174.8	-141	170.2	-131.6	0	0	113.6	R256 D257 G262	R256-E260 PolarHBondContact O-N 3.28Å; D257-E260 PolarHBondContact O-N 3.42Å; E260-G262 PolarHBondContact O-N 3.28Å
261	E	45.5	Very low	49.9	Very low	194 Å²	194	137.3 Å²	137.3	91%	0.907	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	2	172.6	-69.4	-155.9	135.3	0	0	114.6	D257	D257-E261 PolarHBondContact O-N 3.36Å
262	G	46.1	Very low	48.5	Very low	56 Å²	56	136.8 Å²	136.8	58%	0.577	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	1.9	-167.5	0	0	0	0	0	118.4	E260	E260-G262 PolarHBondContact O-N 3.28Å
263	N	45.7	Very low	46.6	Very low	125 Å²	125	135.8 Å²	135.8	67%	0.668	69%	0.694	S	S	*	*			trans	-142.7	66.1	-167.3	-76.8	-72.9	0	0	0	116.6
264	D	36.9	Very low	45.3	Very low	174 Å²	174	135.2 Å²	135.2	93%	0.93	70%	0.704	S	S	*	*			trans	-107.8	93	163.2	-105.7	-25.6	0	0	0	111.2
265	Y	36.2	Very low	43.9	Very low	200 Å²	200	133.8 Å²	133.8	78%	0.784	71%	0.713	S	S	*	*			trans	-92.3	96.6	176.3	-91.9	-93.3	0	0	0	111.8	T267	Y265-T267 PolarHBondContact O-OG1 3Å
266	D	44.7	Very low	42.1	Very low	155 Å²	155	133.1 Å²	133.1	83%	0.829	72%	0.721	S	S	*	*			trans	-72.5	134	163.5	-165.6	2.8	0	0	0	110.4
267	T	42.8	Very low	40.8	Very low	119 Å²	119	134.4 Å²	134.4	73%	0.73	73%	0.734	S	S	*	*			trans	-121	73.3	-164.4	-54.2	0	0	0	0	111.2	Y265	Y265-T267 PolarHBondContact O-OG1 3Å
268	R	38.2	Very low	39.3	Very low	224 Å²	224	134.1 Å²	134.1	85%	0.845	74%	0.739	S	S	*	*			trans	-163.8	117.3	167.5	-108.2	169.5	169.5	134.8	0.9	107.9
269	S	43.8	Very low	38.2	Very low	80 Å²	80	134 Å²	134	56%	0.559	75%	0.748	S	S	*	*			cis	121.9	116.4	48.5	-104.4	0	0	0	0	106.3
270	E	37.1	Very low	37.2	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.822	75%	0.754	S	S	*	*			trans	64.7	132.9	144.7	-62.8	142.9	-106.4	0	0	119.2
271	A	32.8	Very low	36.3	Very low	84 Å²	84	134.6 Å²	134.6	69%	0.694	76%	0.761	S	S	*	*			cis	-165.7	167.2	-8.3	0	0	0	0	0	110.1
272	S	32.8	Very low	35.8	Very low	122 Å²	122	131.5 Å²	131.5	85%	0.853	76%	0.755	S	S	*	*			trans	68.4	152.1	160.3	-64	0	0	0	0	117.5
273	D	31.2	Very low	35.1	Very low	133 Å²	133	136.9 Å²	136.9	71%	0.711	77%	0.771	S	S	*	*			cis	-164.5	138	-17	165.2	37.8	0	0	0	108.4
274	S	32.7	Very low	34.4	Very low	112 Å²	112	134.1 Å²	134.1	78%	0.783	77%	0.772	S	S	*	*			trans	57.4	164.3	166.2	-66.8	0	0	0	0	117.2
275	G	34.1	Very low	34.2	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	77%	0.766	S	S	*	*			cis	-168.5	154.7	-8	0	0	0	0	0	109.1
276	S	29.9	Very low	34	Very low	103 Å²	103	127.7 Å²	127.7	72%	0.72	77%	0.765	S	S	*	*			trans	-71.5	156.5	-174.4	-53.3	0	0	0	0	113.8
277	E	31.2	Very low	33.5	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	77%	0.765	S	S	*	*			trans	65.7	163.5	151.7	-71.9	162.7	-146.3	0	0	118.1
278	S	30.1	Very low	33	Very low	86 Å²	86	131 Å²	131	60%	0.601	77%	0.771	S	S	*	*			cis	-168.8	-154.2	-33.8	63.6	0	0	0	0	107.3
279	V	31.8	Very low	32.7	Very low	145 Å²	145	123.8 Å²	123.8	88%	0.879	77%	0.766	S	S	*	*			trans	57.4	176.1	172	-58.7	0	0	0	0	117.4
280	S	30.6	Very low	32.1	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	79%	0.785	S	S	*	*			trans	-156.1	-173.7	-154.5	57.7	0	0	0	0	112.1
281	F	28.4	Very low	31.7	Very low	190 Å²	190	120.6 Å²	120.6	83%	0.833	77%	0.772	S	S	*	*			trans	81.7	151.9	171.3	-87	-85.3	0	0	0	119.9
282	T	34.1	Very low	32	Very low	128 Å²	128	123.5 Å²	123.5	79%	0.785	78%	0.781	S	S	*	*			trans	66	122.1	-177.5	65.3	0	0	0	0	113.4
283	D	31.3	Very low	31.8	Very low	170 Å²	170	125.3 Å²	125.3	91%	0.909	78%	0.781	S	S	*	*			cis	63.4	145.5	28.4	-163.1	29.9	0	0	0	115
284	G	31.9	Very low	32	Very low	66 Å²	66	121.5 Å²	121.5	68%	0.68	77%	0.773	S	S	*	*			trans	110.4	58	-179.3	0	0	0	0	0	115.5	V286	G284-V286 PolarHBondContact O-N 3.43Å
285	S	32.7	Very low	32.1	Very low	117 Å²	117	121.7 Å²	121.7	82%	0.818	78%	0.775	S	S	*	*			trans	-68.9	124.6	167	175	0	0	0	0	111.8
286	V	32.4	Very low	32.2	Very low	123 Å²	123	123.8 Å²	123.8	75%	0.745	77%	0.77	S	S	*	*			trans	-159.2	109.6	145.8	-93.7	0	0	0	0	115.4	G284	G284-V286 PolarHBondContact O-N 3.43Å
287	R	33.7	Very low	32.4	Very low	220 Å²	220	125.6 Å²	125.6	83%	0.83	77%	0.767	S	S	*	*				72.6	142.7	128.3	-57.9	171.1	77.6	-171.1	6.1	122.1
288	S	32.9	Very low	32.8	Very low	122 Å²	122	123 Å²	123	85%	0.853	75%	0.752	S	S	*	*			trans	74.5	124.1	156.2	-54.5	0	0	0	0	117.8
289	G	30.5	Very low	33.3	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	76%	0.758	S	S	*	*			cis	146.6	176.6	-10.5	0	0	0	0	0	114.2
290	S	31.6	Very low	33.6	Very low	136 Å²	136	127.5 Å²	127.5	95%	0.951	75%	0.749	S	S	*	*			trans	75.2	154.8	173.8	-153.2	0	0	0	0	117.5
291	G	29.8	Very low	33.8	Very low	54 Å²	54	127.9 Å²	127.9	56%	0.557	74%	0.74	S	S	*	*			trans	93.6	109.4	179.5	0	0	0	0	0	113.5
292	T	37.5	Very low	34.4	Very low	144 Å²	144	127.3 Å²	127.3	88%	0.883	73%	0.732	S	S	*	*				67.8	132	60.5	68.6	0	0	0	0	113.7
293	D	30.4	Very low	34.7	Very low	160 Å²	160	129 Å²	129	86%	0.856	73%	0.729	S	S	*	*			cis	-166	168.4	-3.7	175.1	39.5	0	0	0	109.7
294	G	33.7	Very low	35.1	Very low	53 Å²	53	132.3 Å²	132.3	55%	0.546	73%	0.729	S	S	.	*			trans	100.7	120.2	171.3	0	0	0	0	0	113.6
295	S	35	Very low	35.4	Very low	116 Å²	116	133.2 Å²	133.2	81%	0.811	73%	0.73	S	S	*	*			cis	68.7	139.3	31.1	101.2	0	0	0	0	114.3
296	D	36.9	Very low	35.9	Very low	115 Å²	115	139.9 Å²	139.9	62%	0.615	74%	0.737	S	S	*	*			cis	-140.3	168.4	10.4	-168	31	0	0	0	114.2	K298	D296-K298 IonicContact OD1-NZ 2.77Å; D296-K298 IonicContact OD2-NZ 3.71Å; D296-K298 PolarHBondContact OD2-NZ 3.02Å
297	E	34.4	Very low	35.9	Very low	140 Å²	140	137.2 Å²	137.2	65%	0.654	73%	0.734	S	S	*	*			trans	-51.3	168.2	176.2	-52.8	168.4	69.5	0	0	115.5
298	K	39.9	Very low	36.3	Very low	124 Å²	124	135 Å²	135	54%	0.539	74%	0.737	S	S	.	*				179.6	160.2	71.4	-103.3	115.5	-162.2	142.4	0	107.8	D296	D296-K298 IonicContact OD1-NZ 2.77Å; D296-K298 IonicContact OD2-NZ 3.71Å; D296-K298 PolarHBondContact OD2-NZ 3.02Å
299	K	38.9	Very low	36.4	Very low	167 Å²	167	133.9 Å²	133.9	73%	0.726	73%	0.729	S	S	*	*			cis	-166.5	165.3	15.1	-137	161.6	-172.1	163.4	0	111.9
300	K	38.8	Very low	36.9	Very low	159 Å²	159	136.7 Å²	136.7	69%	0.691	73%	0.734	S	S	*	*			trans	75.3	145.5	147.5	-93	166.3	165.4	-107.3	0	118.2
301	E	35.9	Very low	37.3	Very low	109 Å²	109	137.7 Å²	137.7	51%	0.509	73%	0.727	S	S	.	*			cis	-156	134.7	2.2	-163.9	144.7	-166	0	0	117.1
302	R	41	Very low	37.8	Very low	177 Å²	177	140.1 Å²	140.1	67%	0.668	73%	0.731	S	S	*	*			trans	72.4	120.4	148.1	-81.5	170.2	-157.3	-177.5	9.1	124.5
303	K	39.9	Very low	37.8	Very low	163 Å²	163	143.2 Å²	143.2	71%	0.709	73%	0.733	S	S	*	*				71.9	151.6	128.8	-65.5	169.2	-178.4	173.7	0	117.2
304	R	40.3	Very low	38.6	Very low	241 Å²	241	142 Å²	142	91%	0.909	73%	0.726	S	S	*	*			cis	-148	-177.4	8.2	-134	168.6	-175.6	175.7	-1.8	110.6
305	A	36.7	Very low	38.7	Very low	85 Å²	85	151.1 Å²	151.1	70%	0.702	74%	0.744	S	S	*	*			trans	-110.1	161.9	-157.6	0	0	0	0	0	117.8
306	R	42.7	Very low	38.9	Very low	257 Å²	257	151.6 Å²	151.6	97%	0.97	75%	0.747	S	S	*	*			trans	76.6	137.9	154.2	-70.8	171.9	174.8	162.2	-2.6	120.6
307	G	33.7	Very low	38.6	Very low	66 Å²	66	149.8 Å²	149.8	68%	0.68	76%	0.755	S	S	*	*			trans	155	83.1	172.7	0	0	0	0	0	110.1
308	I	40.9	Very low	38.5	Very low	174 Å²	174	149 Å²	149	89%	0.892	77%	0.766	S	S	*	*				74	126.6	92.6	-64	167.4	0	0	0	113
309	S	34.9	Very low	38.3	Very low	99 Å²	99	148.5 Å²	148.5	69%	0.692	78%	0.778	S	S	*	*			trans	-68.3	152.5	-174.9	-44.3	0	0	0	0	114
310	P	41.8	Very low	38.1	Very low	132 Å²	132	144.5 Å²	144.5	86%	0.857	78%	0.776	S	S	*	*			trans	-72	129.2	167.9	30.7	-33.1	0	0	0	110.6
311	I	39.4	Very low	38	Very low	157 Å²	157	142.6 Å²	142.6	81%	0.805	78%	0.783	S	S	*	*			trans	-118.9	137.8	166.3	-71.3	-179.3	0	0	0	108.9
312	V	40	Very low	38	Very low	104 Å²	104	145.7 Å²	145.7	63%	0.63	80%	0.797	S	S	*	*			trans	-25.4	140.5	171.2	-177.8	0	0	0	0	115.7	D314	V312-D314 WeakPolarHBondContact CG1-OD2 3.43Å
313	F	39.1	Very low	37.6	Very low	210 Å²	210	143.2 Å²	143.2	92%	0.921	81%	0.807	S	S	*	*			trans	-129.9	104.3	148.8	-129.4	-77.7	0	0	0	109.8
314	D	47.2	Very low	37.2	Very low	133 Å²	133	145.7 Å²	145.7	71%	0.711	81%	0.813	S	S	*	*			trans	-76.7	134.7	170.4	-76.2	-61.4	0	0	0	110.3	V312	V312-D314 WeakPolarHBondContact CG1-OD2 3.43Å
315	R	35.1	Very low	37	Very low	245 Å²	245	138.9 Å²	138.9	93%	0.925	81%	0.809	S	S	*	*			trans	-161	132.9	131.9	-115	168.6	178.8	-163.6	-3.9	113.8
316	S	39	Very low	36.7	Very low	127 Å²	127	138 Å²	138	89%	0.888	81%	0.808	S	S	*	*			trans	-75.8	154.9	-172.4	36.2	0	0	0	0	114.7
317	G	31.6	Very low	36.4	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	79%	0.794	S	S	*	*			trans	-163.5	118.9	166.8	0	0	0	0	0	110.6
318	S	32	Very low	36.6	Very low	124 Å²	124	136.9 Å²	136.9	87%	0.867	81%	0.807	S	S	*	*			trans	-69.7	164.7	179.9	-46.4	0	0	0	0	111.9
319	S	34.5	Very low	36.6	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	80%	0.8	S	S	*	*			cis	-148.9	150.6	12.5	-158.5	0	0	0	0	112.2
320	A	36.2	Very low	36.8	Very low	84 Å²	84	141.8 Å²	141.8	69%	0.694	81%	0.809	S	S	*	*			trans	-81.8	163.7	153.1	0	0	0	0	0	110.1
321	S	35.9	Very low	36.9	Very low	119 Å²	119	143.4 Å²	143.4	83%	0.832	81%	0.805	S	S	*	*			trans	-142.6	103.4	161.3	58.9	0	0	0	0	107.8
322	E	36	Very low	37.4	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	80%	0.802	S	S	*	*			trans	-75.8	154.5	-179.5	-65.4	163.8	95.6	0	0	111.7
323	S	33.1	Very low	38.5	Very low	125 Å²	125	148 Å²	148	87%	0.874	81%	0.813	S	S	*	*			trans	-141.2	81.4	164.2	-72.7	0	0	0	0	108.5	A325	S323-A325 PolarHBondContact O-N 3.47Å
324	Y	31.8	Very low	39.9	Very low	214 Å²	214	141 Å²	141	84%	0.839	79%	0.785	S	S	*	*			trans	-84.4	106.7	-177.6	-164.6	-82.9	0	0	0	110.7
325	A	34.8	Very low	41.4	Very low	99 Å²	99	138.1 Å²	138.1	82%	0.818	78%	0.775	S	S	*	*			trans	-137.1	100.3	170.9	0	0	0	0	0	108.8	S323	S323-A325 PolarHBondContact O-N 3.47Å
326	G	30.2	Very low	43.4	Very low	66 Å²	66	130.8 Å²	130.8	68%	0.68	76%	0.761	S	S	*	*			trans	-78.7	131.1	-164.8	0	0	0	0	0	115.1
327	S	37.2	Very low	45.1	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	74%	0.744	S	S	*	*			trans	-154.8	91.9	149.4	-167.3	0	0	0	0	108.8	K329	S327-K329 PolarHBondContact O-N 2.73Å
328	E	38	Very low	47.2	Very low	203 Å²	203	127.2 Å²	127.2	95%	0.949	72%	0.722	S	S	*	*			trans	-73.6	71.1	-179.8	-68.1	-163.4	118.3	0	0	112	K330	E328-K330 PolarHBondContact O-N 2.98Å
329	K	40.9	Very low	49.2	Very low	173 Å²	173	128.1 Å²	128.1	75%	0.752	71%	0.706	S	S	*	*			trans	-67.6	115.1	159.6	-68.1	-176.2	-179.5	178.9	0	107.4	S327 H331	S327-K329 PolarHBondContact O-N 2.73Å; K329-H331 VanDerWaalsContact C-N 3.28Å; K329-H331 PolarHBondContact O-N 3.33Å
330	K	39.4	Very low	51	Low	202 Å²	202	124.8 Å²	124.8	88%	0.878	69%	0.686	S	S	*	*			trans	-54.4	93.3	167.5	-85.2	-175.2	174.4	179.1	0	109.1	E328 E332	E328-K330 PolarHBondContact O-N 2.98Å; K330-E332 PolarHBondContact O-N 3.2Å; K330-E332 VanDerWaalsContact O-N 3.1Å
331	H	43.1	Very low	52.7	Low	166 Å²	166	124.5 Å²	124.5	77%	0.769	68%	0.675	S	S	*	*			trans	-73.2	100.5	165.1	-122.9	-75.3	0	0	0	106.5	K329 K333	K329-H331 VanDerWaalsContact C-N 3.28Å; K329-H331 PolarHBondContact O-N 3.33Å; H331-K333 PolarHBondContact O-N 3.26Å; H331-K333 VanDerWaalsContact O-N 3.14Å
332	E	50.2	Low	54.5	Low	160 Å²	160	123.5 Å²	123.5	75%	0.748	65%	0.653	S	S	*	*			trans	-52.8	123.6	170.9	-64.7	-169.4	139.6	0	0	108.3	K330 L334	K330-E332 PolarHBondContact O-N 3.2Å; K330-E332 VanDerWaalsContact O-N 3.1Å; E332-L334 PolarHBondContact O-N 2.98Å
333	K	62.9	Low	56.3	Low	198 Å²	198	122 Å²	122	86%	0.861	64%	0.644	S	S	*	*			trans	-77.9	74.2	-178.8	-73.6	-177.2	179.1	174.1	0	109	H331	H331-K333 PolarHBondContact O-N 3.26Å; H331-K333 VanDerWaalsContact O-N 3.14Å
334	L	67.8	Low	58.6	Low	64 Å²	64	120.3 Å²	120.3	34%	0.335	63%	0.625	S	S	.	*			trans	-32.4	135.9	173.2	-65	167.5	0	0	0	111.5	E332 V338 R339 R342	E332-L334 PolarHBondContact O-N 2.98Å; L334-V338 HydrophobicContact CD2-CG1 4.36Å; L334-R339 HydrophobicContact CB-CG 4.17Å; L334-R339 PolarHBondContact O-NE 3.3Å; L334-R339 PolarHBondContact O-NH2 2.98Å; L334-R342 VanDerWaalsContact CD1-NH1 3.29Å
335	S	80.1	Confident	61	Low	72 Å²	72	113 Å²	113	50%	0.503	60%	0.599	S	S	.	*			trans	-52	151.5	179.2	-179.5	0	0	0	0	111.9	S337 V338 R339	S335-S337 PolarHBondContact O-N 3.37Å; S335-V338 PolarHBondContact O-N 3.38Å; S335-V338 VanDerWaalsContact O-N 3.16Å; S335-R339 PolarHBondContact O-N 3.33Å
336	S	76.5	Confident	63.6	Low	90 Å²	90	111.3 Å²	111.3	63%	0.629	58%	0.578	S	S	*	*	H	α-helix	trans	-54.9	-41.6	178.9	45.2	0	0	0	0	111.9	R339 A340	S336-R339 PolarHBondContact O-N 3.02Å; S336-A340 PolarHBondContact O-N 3.49Å
337	S	75.5	Confident	66.6	Low	75 Å²	75	111.2 Å²	111.2	52%	0.524	57%	0.567	S	S	.	*	H	α-helix	trans	-59	-51.4	174.2	175.2	0	0	0	0	112	S335 R339 A340 V341	S335-S337 PolarHBondContact O-N 3.37Å; S337-R339 PolarHBondContact O-N 3.09Å; S337-A340 WeakPolarHBondContact O-CA 3.39Å; S337-A340 WeakPolarHBondContact O-CB 3.3Å; S337-A340 PolarHBondContact O-N 3.23Å; S337-V341 PolarHBondContact O-N 2.83Å
338	V	74.5	Confident	69.2	Low	53 Å²	53	110 Å²	110	32%	0.321	55%	0.55	S	S	.	*	H	α-helix	trans	-62.4	-29.4	178.9	-175.4	0	0	0	0	112.1	L334 S335 R342	L334-V338 HydrophobicContact CD2-CG1 4.36Å; S335-V338 PolarHBondContact O-N 3.38Å; S335-V338 VanDerWaalsContact O-N 3.16Å; V338-R342 WeakPolarHBondContact O-CB 3.36Å; V338-R342 WeakPolarHBondContact O-CG 3.42Å; V338-R342 PolarHBondContact O-N 3.06Å
339	R	75.3	Confident	71.9	Confident	143 Å²	143	101.3 Å²	101.3	54%	0.54	51%	0.51	S	S	.	.	H	α-helix	trans	-74.2	-31.9	171.6	-86.2	-178.4	-81.2	162.8	-6.1	113.6	L334 S335 S336 S337 K343	L334-R339 HydrophobicContact CB-CG 4.17Å; L334-R339 PolarHBondContact O-NE 3.3Å; L334-R339 PolarHBondContact O-NH2 2.98Å; S335-R339 PolarHBondContact O-N 3.33Å; S336-R339 PolarHBondContact O-N 3.02Å; S337-R339 PolarHBondContact O-N 3.09Å; R339-K343 WeakPolarHBondContact O-CB 3.38Å; R339-K343 PolarHBondContact O-N 3.02Å
340	A	70.8	Confident	74.4	Confident	44 Å²	44	98.7 Å²	98.7	36%	0.364	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-58.1	171.4	0	0	0	0	0	110.3	S336 S337 R342 K343 D344	S336-A340 PolarHBondContact O-N 3.49Å; S337-A340 WeakPolarHBondContact O-CA 3.39Å; S337-A340 WeakPolarHBondContact O-CB 3.3Å; S337-A340 PolarHBondContact O-N 3.23Å; A340-R342 VanDerWaalsContact C-N 3.27Å; A340-R342 PolarHBondContact O-N 2.61Å; A340-R342 VanDerWaalsContact O-N 3.11Å; A340-K343 CarbonylContact O-C 3.58Å; A340-K343 WeakPolarHBondContact O-CA 3.42Å; A340-K343 VanDerWaalsContact O-CB 3.28Å; A340-K343 WeakPolarHBondContact O-CB 3.44Å; A340-K343 PolarHBondContact O-N 3.19Å; A340-D344 VanDerWaalsContact O-CG 3.26Å; A340-D344 PolarHBondContact O-N 3.06Å; A340-D344 VanDerWaalsContact O-OD2 3.13Å
341	V	73.1	Confident	77.1	Confident	78 Å²	78	93.5 Å²	93.5	47%	0.473	47%	0.474	S	S	.	.	H	α-helix	trans	-52.2	-42.1	-179.1	177.7	0	0	0	0	112.5	S337 D344 Q345	S337-V341 PolarHBondContact O-N 2.83Å; V341-D344 PolarHBondContact O-N 3.43Å; V341-Q345 PolarHBondContact O-N 2.8Å
342	R	72.6	Confident	79.5	Confident	97 Å²	97	85.6 Å²	85.6	37%	0.366	44%	0.437	S	S	.	.	H	α-helix	trans	-71.6	-30.6	176.2	-72.4	-178.5	179.7	144.6	8.2	114	L334 V338 A340 D344 T346	L334-R342 VanDerWaalsContact CD1-NH1 3.29Å; V338-R342 WeakPolarHBondContact O-CB 3.36Å; V338-R342 WeakPolarHBondContact O-CG 3.42Å; V338-R342 PolarHBondContact O-N 3.06Å; A340-R342 VanDerWaalsContact C-N 3.27Å; A340-R342 PolarHBondContact O-N 2.61Å; A340-R342 VanDerWaalsContact O-N 3.11Å; R342-D344 VanDerWaalsContact C-N 3.29Å; R342-T346 WeakPolarHBondContact O-CB 3.42Å; R342-T346 WeakPolarHBondContact O-CG2 3.44Å; R342-T346 PolarHBondContact O-N 2.98Å; R342-T346 PolarHBondContact O-OG1 2.7Å
343	K	75.1	Confident	81.7	Confident	142 Å²	142	78.1 Å²	78.1	62%	0.617	40%	0.402	S	S	*	.	H	α-helix	trans	-68	-34	171.7	-170.4	-171	176.4	-165.1	0	110.8	R339 A340 T346 S347	R339-K343 WeakPolarHBondContact O-CB 3.38Å; R339-K343 PolarHBondContact O-N 3.02Å; A340-K343 CarbonylContact O-C 3.58Å; A340-K343 WeakPolarHBondContact O-CA 3.42Å; A340-K343 VanDerWaalsContact O-CB 3.28Å; A340-K343 WeakPolarHBondContact O-CB 3.44Å; A340-K343 PolarHBondContact O-N 3.19Å; K343-T346 WeakPolarHBondContact CA-OG1 3.29Å; K343-T346 PolarHBondContact O-OG1 2.91Å; K343-S347 WeakPolarHBondContact O-CB 3.35Å; K343-S347 PolarHBondContact O-N 3.14Å; K343-S347 PolarHBondContact O-OG 3.01Å
344	D	79.9	Confident	83.2	Confident	91 Å²	91	73 Å²	73	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-78.8	-43.4	-178.5	-56.3	-31.4	0	0	0	111.1	A340 V341 R342 T346 S347 K348	A340-D344 VanDerWaalsContact O-CG 3.26Å; A340-D344 PolarHBondContact O-N 3.06Å; A340-D344 VanDerWaalsContact O-OD2 3.13Å; V341-D344 PolarHBondContact O-N 3.43Å; R342-D344 VanDerWaalsContact C-N 3.29Å; D344-T346 PolarHBondContact O-N 3.33Å; D344-S347 WeakPolarHBondContact O-CB 3.42Å; D344-S347 PolarHBondContact O-N 3.4Å; D344-K348 PolarHBondContact O-N 2.77Å
345	Q	84.1	Confident	84.4	Confident	60 Å²	60	74.4 Å²	74.4	28%	0.28	39%	0.389	S	S	.	.	H	α-helix	trans	-57.2	-46.9	168.8	-79.7	-174.2	-17.5	0	0	112.3	V341 S347 K348 L349	V341-Q345 PolarHBondContact O-N 2.8Å; Q345-S347 VanDerWaalsContact C-N 3.26Å; Q345-S347 PolarHBondContact O-N 3.32Å; Q345-K348 PolarHBondContact O-N 3.27Å; Q345-L349 WeakPolarHBondContact O-CB 3.42Å; Q345-L349 PolarHBondContact O-N 2.97Å
346	T	88.8	Confident	85.2	Confident	63 Å²	63	71.2 Å²	71.2	39%	0.387	37%	0.368	S	S	.	.	H	α-helix	trans	-68.9	-25	178.4	51.2	0	0	0	0	112.9	R342 K343 D344 K350	R342-T346 WeakPolarHBondContact O-CB 3.42Å; R342-T346 WeakPolarHBondContact O-CG2 3.44Å; R342-T346 PolarHBondContact O-N 2.98Å; R342-T346 PolarHBondContact O-OG1 2.7Å; K343-T346 WeakPolarHBondContact CA-OG1 3.29Å; K343-T346 PolarHBondContact O-OG1 2.91Å; D344-T346 PolarHBondContact O-N 3.33Å; T346-K350 WeakPolarHBondContact O-CB 3.38Å; T346-K350 VanDerWaalsContact O-CG 3.27Å; T346-K350 WeakPolarHBondContact O-CG 3.48Å; T346-K350 PolarHBondContact O-N 3.49Å
347	S	91.8	Very high	86.3	Confident	65 Å²	65	70.1 Å²	70.1	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-71.8	-46	169.2	-58.7	0	0	0	0	112.2	K343 D344 Q345 L349 K350 Y351	K343-S347 WeakPolarHBondContact O-CB 3.35Å; K343-S347 PolarHBondContact O-N 3.14Å; K343-S347 PolarHBondContact O-OG 3.01Å; D344-S347 WeakPolarHBondContact O-CB 3.42Å; D344-S347 PolarHBondContact O-N 3.4Å; Q345-S347 VanDerWaalsContact C-N 3.26Å; Q345-S347 PolarHBondContact O-N 3.32Å; S347-L349 VanDerWaalsContact C-N 3.34Å; S347-L349 PolarHBondContact O-N 3.23Å; S347-K350 PolarHBondContact O-N 3.14Å; S347-Y351 PolarHBondContact O-N 3.12Å
348	K	92.9	Very high	87.4	Confident	72 Å²	72	66.6 Å²	66.6	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-54.7	-49.9	171.9	-76.2	-173.3	175.9	-174.4	0	110.4	D344 Q345 Y351 V352 D500 L501 I505	D344-K348 PolarHBondContact O-N 2.77Å; Q345-K348 PolarHBondContact O-N 3.27Å; K348-Y351 WeakPolarHBondContact O-CB 3.45Å; K348-Y351 PolarHBondContact O-N 3.39Å; K348-Y351 VanDerWaalsContact O-N 3.16Å; K348-V352 PolarHBondContact O-N 3.17Å; K348-V352 VanDerWaalsContact O-N 3.15Å; K348-D500 IonicContact NZ-OD1 3.9Å; K348-D500 PolarHBondContact NZ-OD1 2.79Å; K348-L501 HydrophobicContact CB-CB 4.06Å; K348-L501 HydrophobicContact CB-CD1 3.88Å; K348-L501 HydrophobicContact CD-CB 3.81Å; K348-I505 HydrophobicContact CB-CD1 3.97Å; K348-I505 HydrophobicContact CG-CD1 4.18Å
349	L	94.8	Very high	88.5	Confident	20 Å²	20	64.1 Å²	64.1	11%	0.105	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-47.2	179.9	179.8	57.7	0	0	0	112	Q345 S347 Y351 V352 L353 F413 I449 L491 L501	Q345-L349 WeakPolarHBondContact O-CB 3.42Å; Q345-L349 PolarHBondContact O-N 2.97Å; S347-L349 VanDerWaalsContact C-N 3.34Å; S347-L349 PolarHBondContact O-N 3.23Å; L349-Y351 PolarHBondContact O-N 3Å; L349-V352 PolarHBondContact O-N 3.06Å; L349-L353 HydrophobicContact CD1-CD1 3.89Å; L349-L353 HydrophobicContact CD1-CD2 4.4Å; L349-L353 HydrophobicContact CD1-CG 3.92Å; L349-L353 HydrophobicContact CG-CD1 3.9Å; L349-L353 HydrophobicContact CG-CG 4.29Å; L349-L353 WeakPolarHBondContact O-CG 3.5Å; L349-L353 PolarHBondContact O-N 3.41Å; L349-F413 HydrophobicContact CD1-CE2 4.09Å; L349-F413 HydrophobicContact CD1-CZ 4.04Å; L349-F413 HydrophobicContact CD2-CZ 4.44Å; L349-I449 HydrophobicContact CD1-CG2 3.68Å; L349-L491 HydrophobicContact CD2-CD2 4.09Å; L349-L501 HydrophobicContact CB-CD1 4.18Å; L349-L501 HydrophobicContact CD1-CD2 4.44Å
350	K	94.3	Very high	89.6	Confident	117 Å²	117	57.3 Å²	57.3	51%	0.509	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-30.7	175.8	-78.4	177.2	176.1	-173.1	0	113.4	T346 S347 Q354 L491	T346-K350 WeakPolarHBondContact O-CB 3.38Å; T346-K350 VanDerWaalsContact O-CG 3.27Å; T346-K350 WeakPolarHBondContact O-CG 3.48Å; T346-K350 PolarHBondContact O-N 3.49Å; S347-K350 PolarHBondContact O-N 3.14Å; K350-Q354 WeakPolarHBondContact O-CB 3.39Å; K350-Q354 PolarHBondContact O-N 3.21Å; K350-Q354 VanDerWaalsContact O-N 3.08Å; K350-L491 HydrophobicContact CG-CD2 4.31Å
351	Y	94.4	Very high	90.9	Very high	93 Å²	93	55.2 Å²	55.2	37%	0.365	27%	0.267	S	S	.	.	H	α-helix	trans	-70.3	-36.2	173.2	178.8	-102.8	0	0	0	112.5	S347 K348 L349 R396 I505	S347-Y351 PolarHBondContact O-N 3.12Å; K348-Y351 WeakPolarHBondContact O-CB 3.45Å; K348-Y351 PolarHBondContact O-N 3.39Å; K348-Y351 VanDerWaalsContact O-N 3.16Å; L349-Y351 PolarHBondContact O-N 3Å; Y351-R396 PolarHBondContact O-NH1 3.42Å; Y351-R396 PolarHBondContact O-NH2 3.26Å; Y351-I505 HydrophobicContact CD1-CD1 4.04Å; Y351-I505 HydrophobicContact CD1-CG1 4.04Å; Y351-I505 HydrophobicContact CD1-CG2 4.33Å; Y351-I505 HydrophobicContact CE1-CG1 4.42Å; Y351-I505 HydrophobicContact CE1-CG2 3.98Å
352	V	94.9	Very high	92.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.8	-38.6	174.1	174.7	0	0	0	0	111.8	K348 L349 Q354 S397 I449 L501 I505 M508	K348-V352 PolarHBondContact O-N 3.17Å; K348-V352 VanDerWaalsContact O-N 3.15Å; L349-V352 PolarHBondContact O-N 3.06Å; V352-Q354 VanDerWaalsContact C-N 3.33Å; V352-S397 WeakPolarHBondContact O-CB 3.18Å; V352-S397 PolarHBondContact O-OG 3.43Å; V352-I449 HydrophobicContact CG1-CD1 3.78Å; V352-L501 HydrophobicContact CG2-CD2 4.41Å; V352-I505 HydrophobicContact CG2-CD1 3.98Å; V352-I505 HydrophobicContact CG2-CG1 3.5Å; V352-I505 VanDerWaalsContact CG2-CG1 3.5Å; V352-M508 HydrophobicContact CB-SD 4.3Å; V352-M508 HydrophobicContact CG1-SD 3.91Å; V352-M508 HydrophobicContact CG2-SD 4.08Å
353	L	96	Very high	93.2	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	24%	0.235	C	C	.	.	S	Bend	trans	-81.6	-6.8	-179.8	-60.4	-177.1	0	0	0	114.3	L349 D355 A356 F358 I399 T487 C490	L349-L353 HydrophobicContact CD1-CD1 3.89Å; L349-L353 HydrophobicContact CD1-CD2 4.4Å; L349-L353 HydrophobicContact CD1-CG 3.92Å; L349-L353 HydrophobicContact CG-CD1 3.9Å; L349-L353 HydrophobicContact CG-CG 4.29Å; L349-L353 WeakPolarHBondContact O-CG 3.5Å; L349-L353 PolarHBondContact O-N 3.41Å; L353-D355 PolarHBondContact O-N 3.04Å; L353-A356 WeakPolarHBondContact O-CB 3.38Å; L353-A356 PolarHBondContact O-N 3.39Å; L353-F358 HydrophobicContact CB-CZ 4.36Å; L353-F358 HydrophobicContact CD2-CE1 3.85Å; L353-F358 HydrophobicContact CD2-CZ 4.05Å; L353-I399 HydrophobicContact CD2-CD1 3.88Å; L353-I399 HydrophobicContact CD2-CG1 3.78Å; L353-T487 HydrophobicContact CD1-CG2 4.35Å; L353-C490 HydrophobicContact CD1-CB 3.56Å
354	Q	94.4	Very high	94.1	Very high	91 Å²	91	46.1 Å²	46.1	43%	0.425	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	131	177	-172.1	-164.8	-15.5	0	0	110.3	K350 V352 A356 R396	K350-Q354 WeakPolarHBondContact O-CB 3.39Å; K350-Q354 PolarHBondContact O-N 3.21Å; K350-Q354 VanDerWaalsContact O-N 3.08Å; V352-Q354 VanDerWaalsContact C-N 3.33Å; Q354-A356 PolarHBondContact O-N 3.25Å; Q354-R396 VanDerWaalsContact CD-NH1 3.3Å; Q354-R396 WeakPolarHBondContact O-CD 3.44Å
355	D	93.4	Very high	94.8	Very high	93 Å²	93	43.8 Å²	43.8	50%	0.497	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	34	179.9	-41.7	-43.9	0	0	0	113	L353 R396	L353-D355 PolarHBondContact O-N 3.04Å; D355-R396 HydrophobicContact CB-CB 4.08Å; D355-R396 PolarHBondContact O-N 3.37Å
356	A	97.2	Very high	95.5	Very high	6 Å²	6	44.7 Å²	44.7	5%	0.05	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	152.6	-178	0	0	0	0	0	113.5	L353 Q354 F358 S397 I399 L483	L353-A356 WeakPolarHBondContact O-CB 3.38Å; L353-A356 PolarHBondContact O-N 3.39Å; Q354-A356 PolarHBondContact O-N 3.25Å; A356-F358 HydrophobicContact CB-CE2 4.17Å; A356-F358 HydrophobicContact CB-CZ 4.18Å; A356-S397 CarbonylContact C-O 3.59Å; A356-S397 WeakPolarHBondContact CA-O 3.38Å; A356-I399 HydrophobicContact CB-CG1 4.16Å; A356-L483 VanDerWaalsContact O-CD1 3.24Å; A356-L483 WeakPolarHBondContact O-CD1 3.37Å
357	R	98.1	Very high	95.9	Very high	67 Å²	67	47 Å²	47	25%	0.253	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.9	166.4	-66.9	177.3	70.5	179.4	-1.1	109.7	F359 S394 A395 S397 V398 I399 E480	R357-F359 HydrophobicContact CB-CE2 3.93Å; R357-S394 PolarHBondContact NH1-OG 3.06Å; R357-A395 HydrophobicContact CB-CB 4.31Å; R357-A395 HydrophobicContact CG-CB 3.75Å; R357-S397 PolarHBondContact N-O 3.41Å; R357-V398 WeakPolarHBondContact O-CA 3.47Å; R357-I399 PolarHBondContact O-N 3.17Å; R357-E480 IonicContact CZ-OE1 3.44Å; R357-E480 IonicContact CZ-OE2 2.83Å; R357-E480 IonicContact NE-OE1 2.68Å; R357-E480 PolarHBondContact NE-OE1 2.88Å; R357-E480 IonicContact NH2-OE1 3.78Å; R357-E480 PolarHBondContact NH2-OE1 3.16Å; R357-E480 IonicContact NH2-OE2 2.66Å; R357-E480 PolarHBondContact NH2-OE2 3.49Å
358	F	98.5	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.6	-173.7	-64.4	-88.7	0	0	0	111.3	L353 A356 I399 I401 E480 I481 L483 T487	L353-F358 HydrophobicContact CB-CZ 4.36Å; L353-F358 HydrophobicContact CD2-CE1 3.85Å; L353-F358 HydrophobicContact CD2-CZ 4.05Å; A356-F358 HydrophobicContact CB-CE2 4.17Å; A356-F358 HydrophobicContact CB-CZ 4.18Å; F358-I399 WeakPolarHBondContact CA-O 3.18Å; F358-I399 HydrophobicContact CD1-CB 3.57Å; F358-I399 HydrophobicContact CD1-CG1 4.05Å; F358-I399 HydrophobicContact CD1-CG2 3.77Å; F358-I399 HydrophobicContact CE1-CB 3.87Å; F358-I399 HydrophobicContact CE1-CG1 3.86Å; F358-I399 HydrophobicContact CE1-CG2 3.96Å; F358-I399 HydrophobicContact CG-CB 4.41Å; F358-I401 HydrophobicContact CD1-CD1 4.05Å; F358-E480 CarbonylContact O-C 3.56Å; F358-E480 WeakPolarHBondContact O-CA 3.32Å; F358-E480 WeakPolarHBondContact O-CG 3.47Å; F358-I481 HydrophobicContact CB-CB 3.9Å; F358-I481 PolarHBondContact O-N 3.19Å; F358-L483 HydrophobicContact CE2-CD1 4.24Å; F358-L483 WeakPolarHBondContact CE2-O 3.47Å; F358-T487 WeakPolarHBondContact CZ-OG1 3.38Å
359	F	98.6	Very high	96.4	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.5	177.3	-63.7	-90.2	0	0	0	111.3	R357 L388 A391 V398 I399 L400 I401 Q479 E480	R357-F359 HydrophobicContact CB-CE2 3.93Å; F359-L388 HydrophobicContact CB-CD2 4.17Å; F359-L388 HydrophobicContact CD1-CD2 4.27Å; F359-L388 HydrophobicContact CD2-CD2 3.61Å; F359-L388 HydrophobicContact CE2-CD2 4.05Å; F359-L388 HydrophobicContact CG-CD2 3.74Å; F359-A391 HydrophobicContact CE2-CB 3.58Å; F359-A391 HydrophobicContact CZ-CB 3.71Å; F359-V398 HydrophobicContact CD2-CG1 3.72Å; F359-V398 HydrophobicContact CE2-CG1 3.84Å; F359-I399 PolarHBondContact N-O 3.26Å; F359-L400 HydrophobicContact CB-CD2 4.19Å; F359-I401 PolarHBondContact O-N 3.47Å; F359-Q479 WeakPolarHBondContact CA-O 3.37Å; F359-E480 HydrophobicContact CD1-CB 3.99Å; F359-E480 HydrophobicContact CD1-CG 3.99Å; F359-E480 HydrophobicContact CE1-CB 3.72Å; F359-E480 HydrophobicContact CE1-CG 3.5Å; F359-E480 WeakPolarHBondContact CE1-OE2 3.43Å; F359-E480 HydrophobicContact CE2-CG 4.43Å; F359-E480 HydrophobicContact CZ-CB 4.46Å; F359-E480 VanDerWaalsContact CZ-CD 3.47Å; F359-E480 HydrophobicContact CZ-CG 3.76Å
360	L	98.5	Very high	96.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.7	173	-175.3	63.3	0	0	0	109.8	K362 F410 G478 Q479 I481	L360-K362 HydrophobicContact CG-CG 4.34Å; L360-F410 HydrophobicContact CD1-CD1 4.32Å; L360-F410 HydrophobicContact CD1-CE1 3.78Å; L360-G478 PolarHBondContact O-N 2.96Å; L360-Q479 HydrophobicContact CB-CB 4.25Å; L360-Q479 PolarHBondContact N-O 2.94Å; L360-I481 HydrophobicContact CB-CD1 4.15Å
361	I	98.3	Very high	96.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.3	175.7	-60.4	-55.6	0	0	0	109.9	W378 L400 I401 F402 S403 D477	I361-W378 HydrophobicContact CG2-CH2 4.26Å; I361-W378 HydrophobicContact CG2-CZ2 3.37Å; I361-L400 HydrophobicContact CD1-CD2 4.23Å; I361-L400 HydrophobicContact CG1-CB 3.93Å; I361-L400 HydrophobicContact CG1-CD1 4.33Å; I361-L400 HydrophobicContact CG1-CD2 4.17Å; I361-L400 HydrophobicContact CG1-CG 4.37Å; I361-I401 PolarHBondContact N-O 2.93Å; I361-F402 HydrophobicContact CB-CD1 4.03Å; I361-F402 HydrophobicContact CB-CE1 4.17Å; I361-F402 HydrophobicContact CG2-CD1 3.73Å; I361-F402 HydrophobicContact CG2-CE1 3.7Å; I361-S403 PolarHBondContact O-N 2.6Å; I361-D477 WeakPolarHBondContact CA-OD1 3.46Å
362	K	97.1	Very high	96.8	Very high	28 Å²	28	36 Å²	36	12%	0.122	18%	0.184	C	C	.	.			trans	-119.2	76	-172.4	-75.2	-61	-166.2	-179.8	0	112.6	L360 S403 K473 D477	L360-K362 HydrophobicContact CG-CG 4.34Å; K362-S403 WeakPolarHBondContact CA-O 3.35Å; K362-S403 VanDerWaalsContact CD-O 3.3Å; K362-S403 WeakPolarHBondContact CD-O 3.37Å; K362-S403 PolarHBondContact NZ-OG 2.86Å; K362-K473 PolarHBondContact NZ-O 3.24Å; K362-D477 HydrophobicContact CB-CB 3.99Å; K362-D477 PolarHBondContact N-OD1 2.83Å
363	S	96.3	Very high	97	Very high	8 Å²	8	38.2 Å²	38.2	6%	0.056	19%	0.194	C	C	.	.			trans	-61.1	144.2	170.4	-172.6	0	0	0	0	111.8	N365 V404 R405	S363-N365 PolarHBondContact OG-N 3.1Å; S363-N365 VanDerWaalsContact OG-N 3.14Å; S363-N365 PolarHBondContact OG-O 2.81Å; S363-V404 WeakPolarHBondContact O-CA 3.29Å; S363-R405 PolarHBondContact O-N 2.67Å
364	N	94.3	Very high	97	Very high	90 Å²	90	42.4 Å²	42.4	48%	0.481	23%	0.229	S	C	.	.	S	Bend	trans	-82.4	-22.5	170	-62.4	-22.5	0	0	0	112.3	R405	N364-R405 WeakPolarHBondContact OD1-CD 3.5Å; N364-R405 PolarHBondContact OD1-NE 3.22Å; N364-R405 PolarHBondContact OD1-NH2 3.14Å
365	N	95.2	Very high	97.1	Very high	41 Å²	41	43.7 Å²	43.7	22%	0.219	23%	0.233	C	C	.	.			trans	-130	146.2	-173.7	-166.2	-13.5	0	0	0	111.5	S363 E367	S363-N365 PolarHBondContact OG-N 3.1Å; S363-N365 VanDerWaalsContact OG-N 3.14Å; S363-N365 PolarHBondContact OG-O 2.81Å; N365-E367 VanDerWaalsContact ND2-CD 3.33Å; N365-E367 PolarHBondContact ND2-OE1 3.33Å; N365-E367 PolarHBondContact OD1-N 3.1Å; N365-E367 PolarHBondContact OD1-OE1 3.3Å
366	H	97	Very high	97.3	Very high	80 Å²	80	40.2 Å²	40.2	37%	0.37	22%	0.219	S	C	.	.	H	α-helix	trans	-64.8	-37	167.6	-82.9	-85.7	0	0	0	112.4	N368 V369 S370	H366-N368 PolarHBondContact O-N 2.91Å; H366-V369 WeakPolarHBondContact O-CA 3.45Å; H366-V369 PolarHBondContact O-N 2.86Å; H366-S370 PolarHBondContact O-N 3.24Å; H366-S370 PolarHBondContact O-OG 3.29Å
367	E	97.5	Very high	97.3	Very high	111 Å²	111	40.9 Å²	40.9	52%	0.519	22%	0.223	S	C	.	.	H	α-helix	trans	-56.4	-47.3	-177.4	-67.7	165.7	-107	0	0	112.3	N365 V369 S370 L371 V430	N365-E367 VanDerWaalsContact ND2-CD 3.33Å; N365-E367 PolarHBondContact ND2-OE1 3.33Å; N365-E367 PolarHBondContact OD1-N 3.1Å; N365-E367 PolarHBondContact OD1-OE1 3.3Å; E367-V369 VanDerWaalsContact C-N 3.26Å; E367-V369 PolarHBondContact O-N 3.31Å; E367-S370 WeakPolarHBondContact O-CB 3.08Å; E367-S370 PolarHBondContact O-N 3.44Å; E367-S370 VanDerWaalsContact O-N 3.1Å; E367-L371 WeakPolarHBondContact O-CB 3.28Å; E367-L371 PolarHBondContact O-N 3.17Å; E367-V430 HydrophobicContact CB-CG2 4.03Å
368	N	97.3	Very high	97.3	Very high	17 Å²	17	38.5 Å²	38.5	9%	0.091	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-32.7	176.4	-66.1	-20.3	0	0	0	112.7	H366 A372 W378 W429 V430	H366-N368 PolarHBondContact O-N 2.91Å; N368-A372 VanDerWaalsContact O-CB 3.25Å; N368-A372 WeakPolarHBondContact O-CB 3.36Å; N368-A372 PolarHBondContact O-N 2.86Å; N368-W378 HydrophobicContact CB-CZ3 4.28Å; N368-W429 HydrophobicContact CB-CE3 4.02Å; N368-W429 HydrophobicContact CB-CZ3 4.27Å; N368-W429 WeakPolarHBondContact O-CZ3 3.37Å; N368-V430 PolarHBondContact ND2-O 3.11Å; N368-V430 WeakPolarHBondContact OD1-CB 3.24Å; N368-V430 PolarHBondContact OD1-N 3.38Å
369	V	98.1	Very high	97.2	Very high	4 Å²	4	39 Å²	39	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-76	-33	176.2	179.9	0	0	0	0	111.2	H366 E367 K373 F402 V404 Q411 W448	H366-V369 WeakPolarHBondContact O-CA 3.45Å; H366-V369 PolarHBondContact O-N 2.86Å; E367-V369 VanDerWaalsContact C-N 3.26Å; E367-V369 PolarHBondContact O-N 3.31Å; V369-K373 WeakPolarHBondContact O-CB 3.39Å; V369-K373 VanDerWaalsContact O-CG 3.26Å; V369-K373 WeakPolarHBondContact O-CG 3.34Å; V369-K373 PolarHBondContact O-N 3.47Å; V369-F402 HydrophobicContact CG2-CD1 4.46Å; V369-V404 HydrophobicContact CB-CG2 4.31Å; V369-V404 HydrophobicContact CG2-CG2 3.68Å; V369-Q411 HydrophobicContact CG1-CB 3.8Å; V369-Q411 HydrophobicContact CG1-CG 4.25Å; V369-W448 HydrophobicContact CG1-CH2 4.39Å
370	S	97.8	Very high	97	Very high	76 Å²	76	39.1 Å²	39.1	53%	0.531	22%	0.218	S	C	.	.	H	α-helix	trans	-66.8	-43.9	171.5	-61.2	0	0	0	0	111.7	H366 E367 K373 A374	H366-S370 PolarHBondContact O-N 3.24Å; H366-S370 PolarHBondContact O-OG 3.29Å; E367-S370 WeakPolarHBondContact O-CB 3.08Å; E367-S370 PolarHBondContact O-N 3.44Å; E367-S370 VanDerWaalsContact O-N 3.1Å; S370-K373 WeakPolarHBondContact O-CB 3.45Å; S370-K373 PolarHBondContact O-N 3.17Å; S370-A374 PolarHBondContact O-N 3.22Å
371	L	97.1	Very high	96.9	Very high	40 Å²	40	42.7 Å²	42.7	21%	0.209	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-48.5	174.8	-160.8	171.3	0	0	0	110.3	E367 K373 A374 K375 I427 H428 W429	E367-L371 WeakPolarHBondContact O-CB 3.28Å; E367-L371 PolarHBondContact O-N 3.17Å; L371-K373 VanDerWaalsContact C-N 3.27Å; L371-K373 PolarHBondContact O-N 2.99Å; L371-A374 PolarHBondContact O-N 2.82Å; L371-A374 VanDerWaalsContact O-N 3.08Å; L371-K375 HydrophobicContact CD2-CB 4.23Å; L371-K375 HydrophobicContact CD2-CD 3.92Å; L371-K375 HydrophobicContact CD2-CG 4.06Å; L371-K375 PolarHBondContact O-N 2.76Å; L371-I427 HydrophobicContact CD1-CG2 4.19Å; L371-I427 HydrophobicContact CD2-CG2 3.61Å; L371-H428 WeakPolarHBondContact CD1-O 3.47Å; L371-W429 HydrophobicContact CB-CZ3 4.19Å; L371-W429 HydrophobicContact CD1-CE3 4.15Å; L371-W429 HydrophobicContact CD1-CZ3 4.36Å; L371-W429 HydrophobicContact CD2-CE3 4.46Å; L371-W429 HydrophobicContact CD2-CH2 4.26Å; L371-W429 HydrophobicContact CD2-CZ3 3.97Å; L371-W429 HydrophobicContact CG-CZ3 4.4Å
372	A	98.1	Very high	96.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-34.9	175.9	0	0	0	0	0	113.5	N368 G376 V377 W378 W429 W448	N368-A372 VanDerWaalsContact O-CB 3.25Å; N368-A372 WeakPolarHBondContact O-CB 3.36Å; N368-A372 PolarHBondContact O-N 2.86Å; A372-G376 WeakPolarHBondContact O-CA 3.36Å; A372-G376 PolarHBondContact O-N 3.4Å; A372-V377 WeakPolarHBondContact CA-O 2.98Å; A372-V377 WeakPolarHBondContact CB-O 3.47Å; A372-W378 HydrophobicContact CB-CE3 3.77Å; A372-W378 HydrophobicContact CB-CZ3 4.16Å; A372-W429 HydrophobicContact CB-CH2 4.28Å; A372-W429 HydrophobicContact CB-CZ3 4.42Å; A372-W448 HydrophobicContact CB-CZ2 4.07Å; A372-W448 PolarHBondContact O-NE1 3.18Å
373	K	97.4	Very high	96.6	Very high	46 Å²	46	49.4 Å²	49.4	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-73.7	-27	175	-78	179.7	-179.5	-173.6	0	114.5	V369 S370 L371 Q411 W448 R451	V369-K373 WeakPolarHBondContact O-CB 3.39Å; V369-K373 VanDerWaalsContact O-CG 3.26Å; V369-K373 WeakPolarHBondContact O-CG 3.34Å; V369-K373 PolarHBondContact O-N 3.47Å; S370-K373 WeakPolarHBondContact O-CB 3.45Å; S370-K373 PolarHBondContact O-N 3.17Å; L371-K373 VanDerWaalsContact C-N 3.27Å; L371-K373 PolarHBondContact O-N 2.99Å; K373-Q411 WeakPolarHBondContact CE-O 3.47Å; K373-Q411 PolarHBondContact NZ-O 2.66Å; K373-W448 HydrophobicContact CB-CZ2 4.36Å; K373-W448 HydrophobicContact CD-CH2 4.41Å; K373-W448 HydrophobicContact CG-CD2 4.03Å; K373-W448 HydrophobicContact CG-CE3 4.15Å; K373-W448 HydrophobicContact CG-CH2 3.61Å; K373-W448 HydrophobicContact CG-CZ2 3.46Å; K373-W448 VanDerWaalsContact CG-CZ2 3.46Å; K373-W448 HydrophobicContact CG-CZ3 3.96Å; K373-R451 HydrophobicContact CD-CB 4.21Å; K373-R451 HydrophobicContact CD-CG 4.24Å; K373-R451 HydrophobicContact CG-CG 4.12Å; K373-R451 PolarHBondContact NZ-O 2.73Å
374	A	96.6	Very high	96.7	Very high	90 Å²	90	49.9 Å²	49.9	74%	0.744	28%	0.283	S	S	*	.	H	α-helix	trans	-86.1	-45.3	179.6	0	0	0	0	0	111.8	S370 L371	S370-A374 PolarHBondContact O-N 3.22Å; L371-A374 PolarHBondContact O-N 2.82Å; L371-A374 VanDerWaalsContact O-N 3.08Å
375	K	96.6	Very high	96.8	Very high	118 Å²	118	46.2 Å²	46.2	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-92	-10.3	-177.4	-73.8	-157.7	175.9	-158.6	0	115.2	L371 V377 I427	L371-K375 HydrophobicContact CD2-CB 4.23Å; L371-K375 HydrophobicContact CD2-CD 3.92Å; L371-K375 HydrophobicContact CD2-CG 4.06Å; L371-K375 PolarHBondContact O-N 2.76Å; K375-V377 VanDerWaalsContact C-N 3.32Å; K375-V377 HydrophobicContact CB-CG2 3.78Å; K375-V377 PolarHBondContact O-N 3.16Å; K375-I427 HydrophobicContact CD-CD1 3.9Å
376	G	97	Very high	96.8	Very high	21 Å²	21	51.6 Å²	51.6	22%	0.216	28%	0.284	C	S	.	.	S	Bend	trans	65	32.9	-177	0	0	0	0	0	113.7	A372 I446	A372-G376 WeakPolarHBondContact O-CA 3.36Å; A372-G376 PolarHBondContact O-N 3.4Å; G376-I446 VanDerWaalsContact O-CG1 3.3Å; G376-I446 WeakPolarHBondContact O-CG1 3.42Å; G376-I446 PolarHBondContact O-N 2.88Å
377	V	97.4	Very high	96.9	Very high	20 Å²	20	51.5 Å²	51.5	12%	0.121	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.4	-177.8	-63.1	0	0	0	0	113.2	A372 K375 I427 W429 V443 F444	A372-V377 WeakPolarHBondContact CA-O 2.98Å; A372-V377 WeakPolarHBondContact CB-O 3.47Å; K375-V377 VanDerWaalsContact C-N 3.32Å; K375-V377 HydrophobicContact CB-CG2 3.78Å; K375-V377 PolarHBondContact O-N 3.16Å; V377-I427 HydrophobicContact CG2-CD1 4.09Å; V377-I427 HydrophobicContact CG2-CG1 4.15Å; V377-I427 HydrophobicContact CG2-CG2 4.46Å; V377-W429 HydrophobicContact CG2-CH2 4.14Å; V377-W429 HydrophobicContact CG2-CZ2 4.17Å; V377-V443 HydrophobicContact CB-CG1 3.66Å; V377-V443 HydrophobicContact CG1-CG1 3.85Å; V377-V443 HydrophobicContact CG2-CG1 4.36Å; V377-F444 CarbonylContact C-O 3.46Å; V377-F444 VanDerWaalsContact CA-O 3.27Å; V377-F444 WeakPolarHBondContact CA-O 3.11Å
378	W	97.9	Very high	96.9	Very high	16 Å²	16	46.4 Å²	46.4	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.5	169.6	-171	-112.4	0	0	0	112.4	I361 N368 A372 F402 W429 F444 I446	I361-W378 HydrophobicContact CG2-CH2 4.26Å; I361-W378 HydrophobicContact CG2-CZ2 3.37Å; N368-W378 HydrophobicContact CB-CZ3 4.28Å; A372-W378 HydrophobicContact CB-CE3 3.77Å; A372-W378 HydrophobicContact CB-CZ3 4.16Å; W378-F402 AromaticContact CD2-CE1 3.65Å; W378-F402 HydrophobicContact CD2-CE1 3.65Å; W378-F402 HydrophobicContact CD2-CZ 4.17Å; W378-F402 AromaticContact CE2-CE1 3.9Å; W378-F402 AromaticContact CE3-CE1 3.71Å; W378-F402 HydrophobicContact CE3-CE1 3.71Å; W378-F402 HydrophobicContact CE3-CZ 4.4Å; W378-F402 HydrophobicContact CG-CE1 4.16Å; W378-F402 HydrophobicContact CG-CZ 4.22Å; W378-F402 HydrophobicContact CH2-CE1 4.26Å; W378-F402 HydrophobicContact CZ2-CE1 4.21Å; W378-F402 HydrophobicContact CZ3-CE1 4.02Å; W378-W429 AromaticContact CE3-CH2 3.95Å; W378-W429 HydrophobicContact CE3-CH2 3.95Å; W378-W429 HydrophobicContact CE3-CZ3 4.22Å; W378-W429 HydrophobicContact CZ3-CH2 4.41Å; W378-W429 HydrophobicContact CZ3-CZ3 4.22Å; W378-F444 PolarHBondContact N-O 2.94Å; W378-F444 PolarHBondContact O-N 3.13Å; W378-I446 HydrophobicContact CB-CD1 4.08Å
379	S	96.4	Very high	96.9	Very high	10 Å²	10	46.7 Å²	46.7	7%	0.07	26%	0.26	C	S	.	.			trans	-128.1	149.8	169.3	-59	0	0	0	0	109.8	W429	S379-W429 PolarHBondContact OG-NE1 3.45Å; S379-W429 VanDerWaalsContact OG-NE1 3.09Å
380	T	95.8	Very high	96.8	Very high	5 Å²	5	52 Å²	52	3%	0.031	29%	0.288	C	S	.	.			trans	-143.2	176.6	179.8	-173.8	0	0	0	0	110.4	N384 E385 L388 G441 F444 D477	T380-N384 HydrophobicContact CG2-CB 3.81Å; T380-N384 WeakPolarHBondContact OG1-CB 3.43Å; T380-E385 HydrophobicContact CG2-CB 4.28Å; T380-L388 HydrophobicContact CG2-CD1 4.18Å; T380-G441 PolarHBondContact O-N 3.16Å; T380-F444 HydrophobicContact CG2-CE2 4.25Å; T380-D477 PolarHBondContact OG1-OD2 3.16Å
381	L	94.9	Very high	96.8	Very high	76 Å²	76	48.3 Å²	48.3	40%	0.398	26%	0.263	S	S	.	.			trans	-68.1	147	177	-62.5	173.9	0	0	0	110.6	V383 N384 E385 M435 M439 L440	L381-V383 PolarHBondContact O-N 3.1Å; L381-N384 PolarHBondContact O-N 3.47Å; L381-E385 PolarHBondContact O-N 3.04Å; L381-M435 HydrophobicContact CD2-CE 3.81Å; L381-M439 WeakPolarHBondContact CD2-O 3.21Å; L381-L440 HydrophobicContact CD2-CD2 4.37Å
382	P	95.1	Very high	96.7	Very high	55 Å²	55	48.8 Å²	48.8	36%	0.357	26%	0.263	S	S	.	.	H	α-helix	trans	-54.7	-24.3	-175.5	-31.8	36.9	0	0	0	116.6	E385 K386	P382-E385 WeakPolarHBondContact CA-OE2 3.5Å; P382-K386 WeakPolarHBondContact O-CG 3.4Å; P382-K386 PolarHBondContact O-N 3.07Å; P382-K386 VanDerWaalsContact O-N 3.16Å
383	V	95.4	Very high	96.6	Very high	113 Å²	113	57.5 Å²	57.5	69%	0.685	30%	0.296	S	S	*	.	H	α-helix	trans	-67.5	-36.4	174	-179.7	0	0	0	0	112.1	L381 K387	L381-V383 PolarHBondContact O-N 3.1Å; V383-K387 WeakPolarHBondContact O-CG 3.43Å
384	N	96.8	Very high	96.4	Very high	18 Å²	18	58.7 Å²	58.7	10%	0.096	31%	0.31	C	S	.	.	H	α-helix	trans	-85.9	-36.7	178	-77.5	-18	0	0	0	111.4	T380 L381 K387 L388 D477 G478	T380-N384 HydrophobicContact CG2-CB 3.81Å; T380-N384 WeakPolarHBondContact OG1-CB 3.43Å; L381-N384 PolarHBondContact O-N 3.47Å; N384-K387 WeakPolarHBondContact O-CB 3.44Å; N384-K387 PolarHBondContact O-N 3.12Å; N384-L388 WeakPolarHBondContact O-CG 3.35Å; N384-L388 PolarHBondContact O-N 3.02Å; N384-D477 VanDerWaalsContact ND2-C 3.27Å; N384-D477 PolarHBondContact ND2-O 2.62Å; N384-D477 VanDerWaalsContact ND2-O 3.08Å; N384-D477 PolarHBondContact ND2-OD2 3.32Å; N384-G478 PolarHBondContact ND2-N 3.05Å
385	E	96.8	Very high	96.3	Very high	13 Å²	13	55.6 Å²	55.6	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-50.7	-56.9	170.9	176.5	-169	-140.6	0	0	111.9	T380 L381 P382 K387 L388 N389 S420 H422 G441 G442 F444	T380-E385 HydrophobicContact CG2-CB 4.28Å; L381-E385 PolarHBondContact O-N 3.04Å; P382-E385 WeakPolarHBondContact CA-OE2 3.5Å; E385-K387 PolarHBondContact O-N 2.83Å; E385-K387 VanDerWaalsContact O-N 3.17Å; E385-L388 WeakPolarHBondContact O-CA 3.41Å; E385-L388 PolarHBondContact O-N 3.37Å; E385-N389 PolarHBondContact O-N 3.16Å; E385-S420 WeakPolarHBondContact CG-OG 3.43Å; E385-S420 PolarHBondContact OE1-OG 3.08Å; E385-H422 IonicContact OE1-CE1 3.14Å; E385-H422 PolarHBondContact OE1-CE1 2.94Å; E385-H422 VanDerWaalsContact OE1-CE1 3.27Å; E385-H422 IonicContact OE1-NE2 3.79Å; E385-G441 WeakPolarHBondContact OE1-CA 3.47Å; E385-G442 PolarHBondContact OE1-N 2.71Å; E385-F444 HydrophobicContact CB-CE2 4.41Å; E385-F444 HydrophobicContact CB-CZ 4.45Å; E385-F444 HydrophobicContact CG-CE2 4.24Å; E385-F444 HydrophobicContact CG-CZ 4.16Å
386	K	96.7	Very high	96.1	Very high	154 Å²	154	51.4 Å²	51.4	67%	0.67	27%	0.265	S	S	*	.	H	α-helix	trans	-58.7	-32.1	179.5	-70.8	177.9	-179.7	-173.7	0	113	P382 L390	P382-K386 WeakPolarHBondContact O-CG 3.4Å; P382-K386 PolarHBondContact O-N 3.07Å; P382-K386 VanDerWaalsContact O-N 3.16Å; K386-L390 WeakPolarHBondContact O-CB 3.1Å; K386-L390 PolarHBondContact O-N 3.42Å
387	K	97.4	Very high	96.1	Very high	79 Å²	79	50.5 Å²	50.5	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-71.8	-38.2	172.9	-70.4	174.4	64.8	-171	0	112.6	V383 N384 E385 A391 G478	V383-K387 WeakPolarHBondContact O-CG 3.43Å; N384-K387 WeakPolarHBondContact O-CB 3.44Å; N384-K387 PolarHBondContact O-N 3.12Å; E385-K387 PolarHBondContact O-N 2.83Å; E385-K387 VanDerWaalsContact O-N 3.17Å; K387-A391 VanDerWaalsContact O-CB 3.24Å; K387-A391 WeakPolarHBondContact O-CB 3.27Å; K387-A391 PolarHBondContact O-N 3.44Å; K387-G478 PolarHBondContact NZ-O 2.97Å
388	L	97.8	Very high	96.1	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-72.1	-41.5	-179.5	-72.6	-179.1	0	0	0	111.9	F359 T380 N384 E385 A391 F392 V398 L400 L416 F444	F359-L388 HydrophobicContact CB-CD2 4.17Å; F359-L388 HydrophobicContact CD1-CD2 4.27Å; F359-L388 HydrophobicContact CD2-CD2 3.61Å; F359-L388 HydrophobicContact CE2-CD2 4.05Å; F359-L388 HydrophobicContact CG-CD2 3.74Å; T380-L388 HydrophobicContact CG2-CD1 4.18Å; N384-L388 WeakPolarHBondContact O-CG 3.35Å; N384-L388 PolarHBondContact O-N 3.02Å; E385-L388 WeakPolarHBondContact O-CA 3.41Å; E385-L388 PolarHBondContact O-N 3.37Å; L388-A391 CarbonylContact O-C 3.47Å; L388-A391 WeakPolarHBondContact O-CB 3.38Å; L388-A391 PolarHBondContact O-N 2.75Å; L388-A391 VanDerWaalsContact O-N 3.17Å; L388-F392 WeakPolarHBondContact O-CB 3.19Å; L388-F392 PolarHBondContact O-N 3.46Å; L388-V398 HydrophobicContact CD2-CG1 3.96Å; L388-L400 HydrophobicContact CD1-CD2 4.09Å; L388-L400 HydrophobicContact CD2-CD2 3.65Å; L388-L416 HydrophobicContact CB-CD1 4.17Å; L388-F444 HydrophobicContact CB-CE1 3.78Å; L388-F444 HydrophobicContact CB-CZ 3.65Å; L388-F444 HydrophobicContact CD1-CE1 4.47Å; L388-F444 HydrophobicContact CD1-CE2 4.24Å; L388-F444 HydrophobicContact CD1-CZ 4.06Å
389	N	97.3	Very high	96.1	Very high	23 Å²	23	48.8 Å²	48.8	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-62	-48.9	173.2	-66.1	-8.5	0	0	0	111	E385 A391 F392 R393 E419 S420 F444	E385-N389 PolarHBondContact O-N 3.16Å; N389-A391 PolarHBondContact O-N 3.05Å; N389-F392 WeakPolarHBondContact O-CB 3.44Å; N389-F392 PolarHBondContact O-N 3.46Å; N389-F392 VanDerWaalsContact O-N 3.09Å; N389-R393 WeakPolarHBondContact O-CG 3.22Å; N389-R393 PolarHBondContact O-N 3.16Å; N389-E419 WeakPolarHBondContact CB-OE2 3.39Å; N389-S420 PolarHBondContact ND2-OG 3Å; N389-S420 PolarHBondContact OD1-N 3.47Å; N389-S420 PolarHBondContact OD1-OG 2.75Å; N389-F444 WeakPolarHBondContact OD1-CE1 3.44Å; N389-F444 WeakPolarHBondContact OD1-CZ 3.36Å
390	L	97.2	Very high	96.3	Very high	115 Å²	115	48.3 Å²	48.3	60%	0.602	24%	0.244	S	C	*	.	H	α-helix	trans	-59	-36.4	174	-177.3	64.4	0	0	0	111.9	K386 S394	K386-L390 WeakPolarHBondContact O-CB 3.1Å; K386-L390 PolarHBondContact O-N 3.42Å; L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 3Å; L390-S394 PolarHBondContact O-OG 2.74Å
391	A	97	Very high	96.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.7	-42.8	174.7	0	0	0	0	0	112.2	F359 K387 L388 N389 S394 A395 V398	F359-A391 HydrophobicContact CE2-CB 3.58Å; F359-A391 HydrophobicContact CZ-CB 3.71Å; K387-A391 VanDerWaalsContact O-CB 3.24Å; K387-A391 WeakPolarHBondContact O-CB 3.27Å; K387-A391 PolarHBondContact O-N 3.44Å; L388-A391 CarbonylContact O-C 3.47Å; L388-A391 WeakPolarHBondContact O-CB 3.38Å; L388-A391 PolarHBondContact O-N 2.75Å; L388-A391 VanDerWaalsContact O-N 3.17Å; N389-A391 PolarHBondContact O-N 3.05Å; A391-S394 WeakPolarHBondContact CA-OG 3.42Å; A391-S394 PolarHBondContact O-N 3.37Å; A391-S394 VanDerWaalsContact O-N 3.13Å; A391-S394 PolarHBondContact O-OG 2.87Å; A391-A395 WeakPolarHBondContact O-CB 3.47Å; A391-A395 PolarHBondContact O-N 3.27Å; A391-V398 VanDerWaalsContact C-CG2 3.41Å; A391-V398 HydrophobicContact CB-CG1 4.34Å; A391-V398 HydrophobicContact CB-CG2 3.67Å
392	F	96.1	Very high	96.6	Very high	49 Å²	49	44.5 Å²	44.5	22%	0.215	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-49.4	-179.5	-173	-98	0	0	0	111.2	L388 N389 S394 V398 L416 E419	L388-F392 WeakPolarHBondContact O-CB 3.19Å; L388-F392 PolarHBondContact O-N 3.46Å; N389-F392 WeakPolarHBondContact O-CB 3.44Å; N389-F392 PolarHBondContact O-N 3.46Å; N389-F392 VanDerWaalsContact O-N 3.09Å; F392-S394 VanDerWaalsContact C-N 3.27Å; F392-S394 PolarHBondContact O-N 3.15Å; F392-V398 HydrophobicContact CB-CG2 4.37Å; F392-L416 HydrophobicContact CB-CD1 4.37Å; F392-L416 HydrophobicContact CD2-CB 3.71Å; F392-L416 HydrophobicContact CD2-CD1 4.19Å; F392-L416 HydrophobicContact CE2-CB 3.99Å; F392-E419 HydrophobicContact CB-CG 4.28Å; F392-E419 HydrophobicContact CD1-CG 3.38Å; F392-E419 HydrophobicContact CE1-CG 3.86Å; F392-E419 HydrophobicContact CG-CG 4Å
393	R	94.4	Very high	96.7	Very high	184 Å²	184	41.9 Å²	41.9	69%	0.694	21%	0.207	S	C	*	.	H	α-helix	trans	-62	-32	174.2	-58.9	177.7	-166	-168.4	1.3	112.9	N389 E419	N389-R393 WeakPolarHBondContact O-CG 3.22Å; N389-R393 PolarHBondContact O-N 3.16Å; R393-E419 WeakPolarHBondContact CD-OE1 3.4Å; R393-E419 WeakPolarHBondContact CG-OE1 3.39Å; R393-E419 IonicContact CZ-OE1 3.02Å; R393-E419 IonicContact CZ-OE2 2.77Å; R393-E419 VanDerWaalsContact CZ-OE2 3.26Å; R393-E419 VanDerWaalsContact NE-CD 3.31Å; R393-E419 IonicContact NE-OE1 2.83Å; R393-E419 PolarHBondContact NE-OE1 2.75Å; R393-E419 IonicContact NE-OE2 2.65Å; R393-E419 PolarHBondContact NE-OE2 2.78Å; R393-E419 IonicContact NH2-OE1 2.88Å; R393-E419 IonicContact NH2-OE2 2.71Å; R393-E419 PolarHBondContact NH2-OE2 2.76Å
394	S	93.6	Very high	96.8	Very high	71 Å²	71	36.6 Å²	36.6	50%	0.497	18%	0.175	S	C	.	.	H	α-helix	trans	-86.8	-20.8	-173.8	73.8	0	0	0	0	116	R357 L390 A391 F392	R357-S394 PolarHBondContact NH1-OG 3.06Å; L390-S394 WeakPolarHBondContact O-CB 3.43Å; L390-S394 PolarHBondContact O-N 3Å; L390-S394 PolarHBondContact O-OG 2.74Å; A391-S394 WeakPolarHBondContact CA-OG 3.42Å; A391-S394 PolarHBondContact O-N 3.37Å; A391-S394 VanDerWaalsContact O-N 3.13Å; A391-S394 PolarHBondContact O-OG 2.87Å; F392-S394 VanDerWaalsContact C-N 3.27Å; F392-S394 PolarHBondContact O-N 3.15Å
395	A	94.3	Very high	96.8	Very high	25 Å²	25	42 Å²	42	21%	0.207	19%	0.194	C	C	.	.	S	Bend	trans	-130.6	160.2	-163.5	0	0	0	0	0	112.3	R357 A391 S397	R357-A395 HydrophobicContact CB-CB 4.31Å; R357-A395 HydrophobicContact CG-CB 3.75Å; A391-A395 WeakPolarHBondContact O-CB 3.47Å; A391-A395 PolarHBondContact O-N 3.27Å; A395-S397 VanDerWaalsContact C-N 3.34Å
396	R	93.3	Very high	96.8	Very high	29 Å²	29	51 Å²	51	11%	0.109	24%	0.236	C	C	.	.	S	Bend	trans	-70	-34.8	178.1	173.4	166.8	174.6	-157.3	-11.9	113	Y351 Q354 D355 M508	Y351-R396 PolarHBondContact O-NH1 3.42Å; Y351-R396 PolarHBondContact O-NH2 3.26Å; Q354-R396 VanDerWaalsContact CD-NH1 3.3Å; Q354-R396 WeakPolarHBondContact O-CD 3.44Å; D355-R396 HydrophobicContact CB-CB 4.08Å; D355-R396 PolarHBondContact O-N 3.37Å; R396-M508 HydrophobicContact CG-CE 3.86Å
397	S	96.4	Very high	96.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	138.5	-179	-61.2	0	0	0	0	108.1	V352 A356 R357 A395 M508	V352-S397 WeakPolarHBondContact O-CB 3.18Å; V352-S397 PolarHBondContact O-OG 3.43Å; A356-S397 CarbonylContact C-O 3.59Å; A356-S397 WeakPolarHBondContact CA-O 3.38Å; R357-S397 PolarHBondContact N-O 3.41Å; A395-S397 VanDerWaalsContact C-N 3.34Å; S397-M508 WeakPolarHBondContact OG-CE 3.43Å
398	V	98.1	Very high	96.7	Very high	1 Å²	1	43 Å²	43	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.3	165.4	177.2	0	0	0	0	107.6	R357 F359 L388 A391 F392 L400 R415 L416	R357-V398 WeakPolarHBondContact O-CA 3.47Å; F359-V398 HydrophobicContact CD2-CG1 3.72Å; F359-V398 HydrophobicContact CE2-CG1 3.84Å; L388-V398 HydrophobicContact CD2-CG1 3.96Å; A391-V398 VanDerWaalsContact C-CG2 3.41Å; A391-V398 HydrophobicContact CB-CG1 4.34Å; A391-V398 HydrophobicContact CB-CG2 3.67Å; F392-V398 HydrophobicContact CB-CG2 4.37Å; V398-L400 HydrophobicContact CG1-CD2 4.32Å; V398-R415 CarbonylContact O-C 3.47Å; V398-R415 VanDerWaalsContact O-CA 3.28Å; V398-R415 WeakPolarHBondContact O-CA 3.16Å; V398-L416 HydrophobicContact CB-CB 4.23Å; V398-L416 HydrophobicContact CB-CD1 3.77Å; V398-L416 HydrophobicContact CB-CG 3.97Å; V398-L416 HydrophobicContact CG1-CD1 3.63Å; V398-L416 HydrophobicContact CG1-CG 3.95Å; V398-L416 HydrophobicContact CG2-CD1 4.4Å; V398-L416 PolarHBondContact O-N 2.98Å
399	I	98.4	Very high	96.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.8	-173.1	-54.1	-60.5	0	0	0	109.4	L353 A356 R357 F358 F359 I401 F413 A414 R415 I449	L353-I399 HydrophobicContact CD2-CD1 3.88Å; L353-I399 HydrophobicContact CD2-CG1 3.78Å; A356-I399 HydrophobicContact CB-CG1 4.16Å; R357-I399 PolarHBondContact O-N 3.17Å; F358-I399 WeakPolarHBondContact CA-O 3.18Å; F358-I399 HydrophobicContact CD1-CB 3.57Å; F358-I399 HydrophobicContact CD1-CG1 4.05Å; F358-I399 HydrophobicContact CD1-CG2 3.77Å; F358-I399 HydrophobicContact CE1-CB 3.87Å; F358-I399 HydrophobicContact CE1-CG1 3.86Å; F358-I399 HydrophobicContact CE1-CG2 3.96Å; F358-I399 HydrophobicContact CG-CB 4.41Å; F359-I399 PolarHBondContact N-O 3.26Å; I399-I401 HydrophobicContact CG2-CG1 4.17Å; I399-F413 HydrophobicContact CG2-CB 4.34Å; I399-F413 HydrophobicContact CG2-CD2 3.84Å; I399-F413 HydrophobicContact CG2-CG 4.5Å; I399-A414 CarbonylContact C-O 3.55Å; I399-A414 WeakPolarHBondContact CA-O 3.28Å; I399-R415 HydrophobicContact CD1-CB 3.78Å; I399-R415 HydrophobicContact CD1-CG 4.27Å; I399-I449 HydrophobicContact CD1-CD1 4.07Å
400	L	98.6	Very high	96.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.5	175.8	-55.9	-168.3	0	0	0	109.1	F359 I361 L388 V398 F402 F413 A414 L416 I446	F359-L400 HydrophobicContact CB-CD2 4.19Å; I361-L400 HydrophobicContact CD1-CD2 4.23Å; I361-L400 HydrophobicContact CG1-CB 3.93Å; I361-L400 HydrophobicContact CG1-CD1 4.33Å; I361-L400 HydrophobicContact CG1-CD2 4.17Å; I361-L400 HydrophobicContact CG1-CG 4.37Å; L388-L400 HydrophobicContact CD1-CD2 4.09Å; L388-L400 HydrophobicContact CD2-CD2 3.65Å; V398-L400 HydrophobicContact CG1-CD2 4.32Å; L400-F402 HydrophobicContact CB-CD2 4.4Å; L400-F402 HydrophobicContact CB-CE2 3.67Å; L400-F402 HydrophobicContact CB-CZ 4.03Å; L400-F402 HydrophobicContact CD1-CZ 4.18Å; L400-F402 WeakPolarHBondContact O-CD2 3.18Å; L400-F413 WeakPolarHBondContact O-CA 3.26Å; L400-F413 WeakPolarHBondContact O-CB 3.43Å; L400-A414 PolarHBondContact N-O 2.84Å; L400-A414 PolarHBondContact O-N 2.87Å; L400-L416 HydrophobicContact CD1-CD2 3.8Å; L400-L416 HydrophobicContact CG-CD2 4.17Å; L400-I446 HydrophobicContact CD1-CG2 4.25Å
401	I	98.6	Very high	96.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.4	178.5	-52.9	-177.3	0	0	0	108.5	F358 F359 I361 I399 F410 F413 I481 L489 F493	F358-I401 HydrophobicContact CD1-CD1 4.05Å; F359-I401 PolarHBondContact O-N 3.47Å; I361-I401 PolarHBondContact N-O 2.93Å; I399-I401 HydrophobicContact CG2-CG1 4.17Å; I401-F410 HydrophobicContact CG2-CD1 3.72Å; I401-F410 HydrophobicContact CG2-CE1 4.18Å; I401-F410 HydrophobicContact CG2-CG 4.33Å; I401-F413 HydrophobicContact CB-CB 4.46Å; I401-F413 HydrophobicContact CG1-CB 4.12Å; I401-I481 HydrophobicContact CD1-CD1 4.27Å; I401-L489 HydrophobicContact CD1-CD2 3.76Å; I401-L489 HydrophobicContact CD1-CG 4.24Å; I401-L489 HydrophobicContact CG2-CD2 4.16Å; I401-F493 HydrophobicContact CG2-CZ 4.31Å
402	F	98.6	Very high	96.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	131	-169.5	-72	-92.8	0	0	0	112.4	I361 V369 W378 L400 F410 Q411 G412 A414 I446 W448	I361-F402 HydrophobicContact CB-CD1 4.03Å; I361-F402 HydrophobicContact CB-CE1 4.17Å; I361-F402 HydrophobicContact CG2-CD1 3.73Å; I361-F402 HydrophobicContact CG2-CE1 3.7Å; V369-F402 HydrophobicContact CG2-CD1 4.46Å; W378-F402 AromaticContact CD2-CE1 3.65Å; W378-F402 HydrophobicContact CD2-CE1 3.65Å; W378-F402 HydrophobicContact CD2-CZ 4.17Å; W378-F402 AromaticContact CE2-CE1 3.9Å; W378-F402 AromaticContact CE3-CE1 3.71Å; W378-F402 HydrophobicContact CE3-CE1 3.71Å; W378-F402 HydrophobicContact CE3-CZ 4.4Å; W378-F402 HydrophobicContact CG-CE1 4.16Å; W378-F402 HydrophobicContact CG-CZ 4.22Å; W378-F402 HydrophobicContact CH2-CE1 4.26Å; W378-F402 HydrophobicContact CZ2-CE1 4.21Å; W378-F402 HydrophobicContact CZ3-CE1 4.02Å; L400-F402 HydrophobicContact CB-CD2 4.4Å; L400-F402 HydrophobicContact CB-CE2 3.67Å; L400-F402 HydrophobicContact CB-CZ 4.03Å; L400-F402 HydrophobicContact CD1-CZ 4.18Å; L400-F402 WeakPolarHBondContact O-CD2 3.18Å; F402-F410 CarbonylContact O-C 3.47Å; F402-F410 WeakPolarHBondContact O-CA 3.29Å; F402-F410 WeakPolarHBondContact O-CB 3.38Å; F402-Q411 PolarHBondContact O-N 3.24Å; F402-G412 PolarHBondContact N-O 3.41Å; F402-A414 HydrophobicContact CE2-CB 4.13Å; F402-I446 HydrophobicContact CE2-CD1 4.35Å; F402-I446 HydrophobicContact CZ-CD1 4.01Å; F402-W448 HydrophobicContact CB-CH2 4.47Å; F402-W448 HydrophobicContact CD1-CH2 4.46Å; F402-W448 AromaticContact CD2-CH2 3.49Å; F402-W448 HydrophobicContact CD2-CH2 3.49Å; F402-W448 VanDerWaalsContact CD2-CH2 3.49Å; F402-W448 HydrophobicContact CD2-CZ2 4.24Å; F402-W448 AromaticContact CD2-CZ3 3.92Å; F402-W448 HydrophobicContact CD2-CZ3 3.92Å; F402-W448 AromaticContact CE2-CH2 3.74Å; F402-W448 HydrophobicContact CE2-CH2 3.74Å; F402-W448 HydrophobicContact CE2-CZ2 4.02Å; F402-W448 HydrophobicContact CE2-CZ3 4.33Å; F402-W448 AromaticContact CG-CH2 3.89Å; F402-W448 HydrophobicContact CG-CH2 3.89Å; F402-W448 HydrophobicContact CZ-CH2 4.34Å; F402-W448 HydrophobicContact CZ-CZ2 4.32Å
403	S	98.3	Very high	97	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.			trans	-141.8	106.8	174.3	177.6	0	0	0	0	111.1	I361 K362 K409 Q411 F456	I361-S403 PolarHBondContact O-N 2.6Å; K362-S403 WeakPolarHBondContact CA-O 3.35Å; K362-S403 VanDerWaalsContact CD-O 3.3Å; K362-S403 WeakPolarHBondContact CD-O 3.37Å; K362-S403 PolarHBondContact NZ-OG 2.86Å; S403-K409 PolarHBondContact OG-O 2.94Å; S403-Q411 VanDerWaalsContact CA-OE1 3.27Å; S403-F456 WeakPolarHBondContact OG-CZ 3.33Å
404	V	98.1	Very high	97.2	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.018	15%	0.15	C	C	.	.			trans	-63.9	135.9	169.2	-175	0	0	0	0	108.7	S363 V369 S407 Q411	S363-V404 WeakPolarHBondContact O-CA 3.29Å; V369-V404 HydrophobicContact CB-CG2 4.31Å; V369-V404 HydrophobicContact CG2-CG2 3.68Å; V404-S407 PolarHBondContact O-OG 2.85Å; V404-Q411 HydrophobicContact CG2-CG 4.05Å
405	R	96.2	Very high	97.4	Very high	131 Å²	131	25.6 Å²	25.6	49%	0.494	13%	0.129	S	C	.	.	S	Bend	trans	-56.5	148.8	176	-65.3	-176.3	-168.1	-170.8	9.7	110.9	S363 N364 S407	S363-R405 PolarHBondContact O-N 2.67Å; N364-R405 WeakPolarHBondContact OD1-CD 3.5Å; N364-R405 PolarHBondContact OD1-NE 3.22Å; N364-R405 PolarHBondContact OD1-NH2 3.14Å; R405-S407 PolarHBondContact O-N 3.26Å
406	E	95.4	Very high	97.5	Very high	201 Å²	201	24.4 Å²	24.4	94%	0.939	12%	0.119	S	C	*	.	S	Bend	trans	58.2	-16.8	-178.9	-72.9	145.5	-131.6	0	0	117.8	G408	E406-G408 PolarHBondContact O-N 3.37Å
407	S	96.6	Very high	97.6	Very high	27 Å²	27	24 Å²	24	19%	0.189	12%	0.121	C	C	.	.	S	Bend	trans	-60.9	-8	-177.4	72.5	0	0	0	0	116.9	V404 R405 K409 Q411	V404-S407 PolarHBondContact O-OG 2.85Å; R405-S407 PolarHBondContact O-N 3.26Å; S407-K409 WeakPolarHBondContact O-CD 3.41Å; S407-K409 WeakPolarHBondContact O-CG 3.3Å; S407-K409 PolarHBondContact O-N 3.21Å; S407-K409 VanDerWaalsContact O-N 3.13Å; S407-K409 PolarHBondContact OG-O 2.91Å; S407-Q411 PolarHBondContact OG-NE2 3.48Å
408	G	96.8	Very high	97.6	Very high	39 Å²	39	24.2 Å²	24.2	40%	0.402	12%	0.122	S	C	.	.	S	Bend	trans	68	6.5	178.9	0	0	0	0	0	115.9	E406 F456	E406-G408 PolarHBondContact O-N 3.37Å; G408-F456 WeakPolarHBondContact O-CB 3.4Å; G408-F456 VanDerWaalsContact O-CD2 3.24Å; G408-F456 WeakPolarHBondContact O-CD2 3.46Å; G408-F456 WeakPolarHBondContact O-CG 3.5Å; G408-F456 PolarHBondContact O-N 3.06Å
409	K	97.9	Very high	97.5	Very high	56 Å²	56	25.9 Å²	25.9	24%	0.243	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	166.3	-170.9	63.4	-151.5	170.9	156.4	0	112.7	S403 S407 Q411 E453 L454 F456	S403-K409 PolarHBondContact OG-O 2.94Å; S407-K409 WeakPolarHBondContact O-CD 3.41Å; S407-K409 WeakPolarHBondContact O-CG 3.3Å; S407-K409 PolarHBondContact O-N 3.21Å; S407-K409 VanDerWaalsContact O-N 3.13Å; S407-K409 PolarHBondContact OG-O 2.91Å; K409-Q411 VanDerWaalsContact CG-NE2 3.3Å; K409-E453 WeakPolarHBondContact CD-OE1 3.38Å; K409-E453 WeakPolarHBondContact CD-OE2 3.5Å; K409-E453 WeakPolarHBondContact CE-OE1 3.24Å; K409-E453 WeakPolarHBondContact CE-OE2 3.42Å; K409-E453 IonicContact NZ-OE1 3.09Å; K409-E453 PolarHBondContact NZ-OE1 3.25Å; K409-E453 IonicContact NZ-OE2 3.04Å; K409-E453 PolarHBondContact NZ-OE2 3.02Å; K409-L454 WeakPolarHBondContact CA-O 3.33Å; K409-F456 WeakPolarHBondContact O-CE1 3.24Å; K409-F456 WeakPolarHBondContact O-CZ 3.32Å
410	F	98.5	Very high	97.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	143.7	159.8	-53.5	-86.3	0	0	0	108.6	L360 I401 F402 E453 L454 F456 V472 K473 L489 F493	L360-F410 HydrophobicContact CD1-CD1 4.32Å; L360-F410 HydrophobicContact CD1-CE1 3.78Å; I401-F410 HydrophobicContact CG2-CD1 3.72Å; I401-F410 HydrophobicContact CG2-CE1 4.18Å; I401-F410 HydrophobicContact CG2-CG 4.33Å; F402-F410 CarbonylContact O-C 3.47Å; F402-F410 WeakPolarHBondContact O-CA 3.29Å; F402-F410 WeakPolarHBondContact O-CB 3.38Å; F410-E453 CarbonylContact O-C 3.58Å; F410-E453 VanDerWaalsContact O-CA 3.24Å; F410-E453 WeakPolarHBondContact O-CA 3.39Å; F410-E453 WeakPolarHBondContact O-CB 3.42Å; F410-L454 HydrophobicContact CB-CB 4.32Å; F410-L454 HydrophobicContact CD2-CB 4.25Å; F410-L454 HydrophobicContact CD2-CD2 4.24Å; F410-L454 HydrophobicContact CD2-CG 4.23Å; F410-L454 WeakPolarHBondContact CD2-O 3.42Å; F410-L454 PolarHBondContact N-O 2.75Å; F410-L454 PolarHBondContact O-N 2.71Å; F410-F456 HydrophobicContact CD1-CE1 4.17Å; F410-F456 AromaticContact CD2-CD1 3.82Å; F410-F456 HydrophobicContact CD2-CD1 3.82Å; F410-F456 AromaticContact CD2-CE1 3.86Å; F410-F456 HydrophobicContact CD2-CE1 3.86Å; F410-F456 HydrophobicContact CE1-CE1 4.04Å; F410-F456 AromaticContact CE2-CD1 3.54Å; F410-F456 HydrophobicContact CE2-CD1 3.54Å; F410-F456 AromaticContact CE2-CE1 3.74Å; F410-F456 HydrophobicContact CE2-CE1 3.74Å; F410-F456 HydrophobicContact CG-CD1 4.48Å; F410-F456 HydrophobicContact CG-CE1 4.07Å; F410-F456 AromaticContact CZ-CD1 4Å; F410-F456 HydrophobicContact CZ-CD1 4Å; F410-F456 AromaticContact CZ-CE1 3.83Å; F410-F456 HydrophobicContact CZ-CE1 3.83Å; F410-V472 HydrophobicContact CZ-CG1 4.45Å; F410-K473 HydrophobicContact CZ-CB 4.19Å; F410-L489 HydrophobicContact CD2-CD1 4.29Å; F410-L489 HydrophobicContact CE1-CD2 4.18Å; F410-L489 HydrophobicContact CE2-CD1 3.77Å; F410-L489 HydrophobicContact CE2-CD2 4.37Å; F410-L489 HydrophobicContact CZ-CD1 4.14Å; F410-L489 HydrophobicContact CZ-CD2 3.93Å; F410-F493 HydrophobicContact CB-CE1 4.09Å; F410-F493 HydrophobicContact CB-CZ 3.68Å; F410-F493 HydrophobicContact CG-CZ 4.29Å
411	Q	98.4	Very high	97.1	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.014	16%	0.16	C	C	.	.			trans	-92.5	-11.4	-177.7	-80.8	67.2	34.6	0	0	113.4	V369 K373 F402 S403 V404 S407 K409 R452	V369-Q411 HydrophobicContact CG1-CB 3.8Å; V369-Q411 HydrophobicContact CG1-CG 4.25Å; K373-Q411 WeakPolarHBondContact CE-O 3.47Å; K373-Q411 PolarHBondContact NZ-O 2.66Å; F402-Q411 PolarHBondContact O-N 3.24Å; S403-Q411 VanDerWaalsContact CA-OE1 3.27Å; V404-Q411 HydrophobicContact CG2-CG 4.05Å; S407-Q411 PolarHBondContact OG-NE2 3.48Å; K409-Q411 VanDerWaalsContact CG-NE2 3.3Å; Q411-R452 CarbonylContact C-O 3.55Å
412	G	98.1	Very high	96.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.6	-173.8	-176.6	0	0	0	0	0	111.5	F402 C450	F402-G412 PolarHBondContact N-O 3.41Å; G412-C450 CarbonylContact C-O 3.57Å; G412-C450 WeakPolarHBondContact CA-O 3.36Å
413	F	98.5	Very high	96.1	Very high	3 Å²	3	42.6 Å²	42.6	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.1	170	67.2	-84	0	0	0	112.3	L349 I399 L400 I401 I449 C450 C490 F493	L349-F413 HydrophobicContact CD1-CE2 4.09Å; L349-F413 HydrophobicContact CD1-CZ 4.04Å; L349-F413 HydrophobicContact CD2-CZ 4.44Å; I399-F413 HydrophobicContact CG2-CB 4.34Å; I399-F413 HydrophobicContact CG2-CD2 3.84Å; I399-F413 HydrophobicContact CG2-CG 4.5Å; L400-F413 WeakPolarHBondContact O-CA 3.26Å; L400-F413 WeakPolarHBondContact O-CB 3.43Å; I401-F413 HydrophobicContact CB-CB 4.46Å; I401-F413 HydrophobicContact CG1-CB 4.12Å; F413-I449 HydrophobicContact CD2-CB 3.95Å; F413-I449 HydrophobicContact CD2-CD1 4.38Å; F413-I449 HydrophobicContact CD2-CG2 4.21Å; F413-I449 HydrophobicContact CE2-CB 3.62Å; F413-I449 HydrophobicContact CE2-CD1 4.17Å; F413-I449 HydrophobicContact CE2-CG2 3.36Å; F413-I449 HydrophobicContact CZ-CB 4.24Å; F413-I449 HydrophobicContact CZ-CG2 3.66Å; F413-I449 PolarHBondContact O-N 3.05Å; F413-C450 HydrophobicContact CD1-CB 3.78Å; F413-C450 HydrophobicContact CE1-CB 3.5Å; F413-C450 VanDerWaalsContact CE1-CB 3.5Å; F413-C450 HydrophobicContact CZ-CB 4.15Å; F413-C450 PolarHBondContact N-O 3.45Å; F413-C450 PolarHBondContact O-N 3.06Å; F413-C450 VanDerWaalsContact O-N 3.08Å; F413-C490 HydrophobicContact CD2-CB 4.48Å; F413-C490 HydrophobicContact CE1-CB 4.06Å; F413-C490 HydrophobicContact CE2-CB 3.95Å; F413-C490 HydrophobicContact CZ-CB 3.73Å; F413-F493 HydrophobicContact CD1-CD1 4.14Å; F413-F493 AromaticContact CD1-CD2 3.64Å; F413-F493 HydrophobicContact CD1-CD2 3.64Å; F413-F493 HydrophobicContact CD1-CE1 4.2Å; F413-F493 AromaticContact CD1-CE2 3.68Å; F413-F493 HydrophobicContact CD1-CE2 3.68Å; F413-F493 AromaticContact CD1-CG 3.87Å; F413-F493 HydrophobicContact CD1-CG 3.87Å; F413-F493 AromaticContact CD1-CZ 3.97Å; F413-F493 HydrophobicContact CD1-CZ 3.97Å; F413-F493 HydrophobicContact CE1-CB 3.97Å; F413-F493 HydrophobicContact CE1-CD1 4.35Å; F413-F493 AromaticContact CE1-CD2 3.62Å; F413-F493 HydrophobicContact CE1-CD2 3.62Å; F413-F493 HydrophobicContact CE1-CE2 4.15Å; F413-F493 AromaticContact CE1-CG 3.73Å; F413-F493 HydrophobicContact CE1-CG 3.73Å
414	A	98.4	Very high	95.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	162.7	-178.5	0	0	0	0	0	110.7	I399 L400 F402 I446 D447 W448	I399-A414 CarbonylContact C-O 3.55Å; I399-A414 WeakPolarHBondContact CA-O 3.28Å; L400-A414 PolarHBondContact N-O 2.84Å; L400-A414 PolarHBondContact O-N 2.87Å; F402-A414 HydrophobicContact CE2-CB 4.13Å; A414-I446 HydrophobicContact CB-CB 4.19Å; A414-I446 HydrophobicContact CB-CD1 4.04Å; A414-D447 CarbonylContact C-O 3.5Å; A414-D447 VanDerWaalsContact CA-O 3.28Å; A414-D447 WeakPolarHBondContact CA-O 3.46Å; A414-D447 WeakPolarHBondContact CB-O 3.41Å; A414-W448 HydrophobicContact CB-CD2 3.95Å; A414-W448 HydrophobicContact CB-CE3 4.19Å; A414-W448 HydrophobicContact CB-CG 4.13Å
415	R	97.8	Very high	95.1	Very high	17 Å²	17	49.3 Å²	49.3	6%	0.064	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	141.4	171.4	167.5	178.5	150	-79.6	-18.9	109.5	V398 I399 S417 I446 D447 I449 M508	V398-R415 CarbonylContact O-C 3.47Å; V398-R415 VanDerWaalsContact O-CA 3.28Å; V398-R415 WeakPolarHBondContact O-CA 3.16Å; I399-R415 HydrophobicContact CD1-CB 3.78Å; I399-R415 HydrophobicContact CD1-CG 4.27Å; R415-S417 PolarHBondContact O-N 3.19Å; R415-I446 CarbonylContact O-C 3.58Å; R415-I446 WeakPolarHBondContact O-CA 3.37Å; R415-D447 IonicContact CZ-OD2 3.67Å; R415-D447 PolarHBondContact N-O 3.08Å; R415-D447 IonicContact NH1-OD2 3.26Å; R415-D447 PolarHBondContact NH1-OD2 3.29Å; R415-D447 PolarHBondContact O-N 3.02Å; R415-I449 HydrophobicContact CB-CD1 3.81Å; R415-M508 VanDerWaalsContact CZ-CG 3.41Å
416	L	97.5	Very high	94.8	Very high	0 Å²	0	48 Å²	48	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	128.1	166.1	-66.7	-173	0	0	0	110.9	L388 F392 V398 L400 F444 I446	L388-L416 HydrophobicContact CB-CD1 4.17Å; F392-L416 HydrophobicContact CB-CD1 4.37Å; F392-L416 HydrophobicContact CD2-CB 3.71Å; F392-L416 HydrophobicContact CD2-CD1 4.19Å; F392-L416 HydrophobicContact CE2-CB 3.99Å; V398-L416 HydrophobicContact CB-CB 4.23Å; V398-L416 HydrophobicContact CB-CD1 3.77Å; V398-L416 HydrophobicContact CB-CG 3.97Å; V398-L416 HydrophobicContact CG1-CD1 3.63Å; V398-L416 HydrophobicContact CG1-CG 3.95Å; V398-L416 HydrophobicContact CG2-CD1 4.4Å; V398-L416 PolarHBondContact O-N 2.98Å; L400-L416 HydrophobicContact CD1-CD2 3.8Å; L400-L416 HydrophobicContact CG-CD2 4.17Å; L416-F444 HydrophobicContact CD1-CD1 3.98Å; L416-F444 HydrophobicContact CD1-CE1 4.03Å; L416-F444 HydrophobicContact CD2-CB 3.91Å; L416-F444 HydrophobicContact CD2-CD1 3.58Å; L416-F444 HydrophobicContact CD2-CE1 4.34Å; L416-F444 HydrophobicContact CD2-CG 3.96Å; L416-F444 HydrophobicContact CG-CD1 4.4Å; L416-I446 HydrophobicContact CD2-CG2 3.68Å
417	S	95.5	Very high	94.7	Very high	20 Å²	20	39.4 Å²	39.4	14%	0.14	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-22.3	171	27.7	0	0	0	0	113.6	R415 K445 I446 D447	R415-S417 PolarHBondContact O-N 3.19Å; S417-K445 PolarHBondContact N-O 3.14Å; S417-K445 VanDerWaalsContact OG-C 3.23Å; S417-K445 PolarHBondContact OG-O 3.48Å; S417-K445 VanDerWaalsContact OG-O 3.11Å; S417-I446 PolarHBondContact OG-N 2.78Å; S417-D447 WeakPolarHBondContact CB-OD1 3.28Å; S417-D447 PolarHBondContact OG-OD1 3.04Å
418	S	94.9	Very high	94.6	Very high	7 Å²	7	45.5 Å²	45.5	5%	0.049	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	177.6	169.6	73.2	0	0	0	0	112.1	K445	S418-K445 PolarHBondContact N-O 3.12Å; S418-K445 WeakPolarHBondContact OG-CB 3.43Å; S418-K445 PolarHBondContact OG-N 3.29Å
419	E	96.2	Very high	94.5	Very high	36 Å²	36	45 Å²	45	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-173	157.5	-63.5	-163.3	-164.2	0	0	110.6	N389 F392 R393 H421	N389-E419 WeakPolarHBondContact CB-OE2 3.39Å; F392-E419 HydrophobicContact CB-CG 4.28Å; F392-E419 HydrophobicContact CD1-CG 3.38Å; F392-E419 HydrophobicContact CE1-CG 3.86Å; F392-E419 HydrophobicContact CG-CG 4Å; R393-E419 WeakPolarHBondContact CD-OE1 3.4Å; R393-E419 WeakPolarHBondContact CG-OE1 3.39Å; R393-E419 IonicContact CZ-OE1 3.02Å; R393-E419 IonicContact CZ-OE2 2.77Å; R393-E419 VanDerWaalsContact CZ-OE2 3.26Å; R393-E419 VanDerWaalsContact NE-CD 3.31Å; R393-E419 IonicContact NE-OE1 2.83Å; R393-E419 PolarHBondContact NE-OE1 2.75Å; R393-E419 IonicContact NE-OE2 2.65Å; R393-E419 PolarHBondContact NE-OE2 2.78Å; R393-E419 IonicContact NH2-OE1 2.88Å; R393-E419 IonicContact NH2-OE2 2.71Å; R393-E419 PolarHBondContact NH2-OE2 2.76Å; E419-H421 PolarHBondContact O-CD2 3.4Å; E419-H421 VanDerWaalsContact O-CD2 3.24Å; E419-H421 PolarHBondContact O-N 3.43Å
420	S	95.6	Very high	94.4	Very high	16 Å²	16	45.2 Å²	45.2	11%	0.112	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	113.4	173.1	59.3	0	0	0	0	111.9	E385 N389	E385-S420 WeakPolarHBondContact CG-OG 3.43Å; E385-S420 PolarHBondContact OE1-OG 3.08Å; N389-S420 PolarHBondContact ND2-OG 3Å; N389-S420 PolarHBondContact OD1-N 3.47Å; N389-S420 PolarHBondContact OD1-OG 2.75Å
421	H	93.6	Very high	94.1	Very high	109 Å²	109	47.7 Å²	47.7	51%	0.505	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	145.7	172.9	-62	-100.5	0	0	0	110.8	E419 G442 V443	E419-H421 PolarHBondContact O-CD2 3.4Å; E419-H421 VanDerWaalsContact O-CD2 3.24Å; E419-H421 PolarHBondContact O-N 3.43Å; H421-G442 CarbonylContact O-C 3.56Å; H421-G442 WeakPolarHBondContact O-CA 2.96Å; H421-V443 PolarHBondContact N-O 3.47Å; H421-V443 PolarHBondContact O-N 3.42Å
422	H	91.4	Very high	93.8	Very high	135 Å²	135	50.3 Å²	50.3	63%	0.625	31%	0.306	S	S	*	.	S	Bend	trans	-104.3	176	169.7	-65.1	79	0	0	0	108.5	E385 G424 G442	E385-H422 IonicContact OE1-CE1 3.14Å; E385-H422 PolarHBondContact OE1-CE1 2.94Å; E385-H422 VanDerWaalsContact OE1-CE1 3.27Å; E385-H422 IonicContact OE1-NE2 3.79Å; H422-G424 PolarHBondContact O-N 3.04Å; H422-G442 PolarHBondContact NE2-N 3.33Å
423	G	84.6	Confident	93.4	Very high	91 Å²	91	55.6 Å²	55.6	94%	0.938	35%	0.349	S	S	*	.	S	Bend	trans	77.7	-43.1	179.7	0	0	0	0	0	115.7
424	G	87.9	Confident	92.9	Very high	54 Å²	54	59.4 Å²	59.4	56%	0.557	39%	0.389	S	S	*	.	S	Bend	trans	-58.5	164.5	-177.1	0	0	0	0	0	116.1	H422	H422-G424 PolarHBondContact O-N 3.04Å
425	S	87.9	Confident	92.6	Very high	90 Å²	90	62.2 Å²	62.2	63%	0.629	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-48.8	131.4	-164.8	71.2	0	0	0	0	115	I427	S425-I427 PolarHBondContact O-N 3.26Å
426	P	88.9	Confident	92.2	Very high	103 Å²	103	64.3 Å²	64.3	67%	0.669	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-68.7	124.4	-167.8	25.3	-34.3	0	0	0	112.5
427	I	93.7	Very high	91.8	Very high	21 Å²	21	67.6 Å²	67.6	11%	0.108	45%	0.448	C	S	.	.			trans	-90.5	115.3	177	-50.3	-57.5	0	0	0	110.2	L371 K375 V377 S425 W429 V443	L371-I427 HydrophobicContact CD1-CG2 4.19Å; L371-I427 HydrophobicContact CD2-CG2 3.61Å; K375-I427 HydrophobicContact CD-CD1 3.9Å; V377-I427 HydrophobicContact CG2-CD1 4.09Å; V377-I427 HydrophobicContact CG2-CG1 4.15Å; V377-I427 HydrophobicContact CG2-CG2 4.46Å; S425-I427 PolarHBondContact O-N 3.26Å; I427-W429 HydrophobicContact CB-CD2 4.46Å; I427-W429 HydrophobicContact CB-CZ2 4.29Å; I427-W429 HydrophobicContact CG2-CD2 3.7Å; I427-W429 VanDerWaalsContact CG2-CE2 3.42Å; I427-W429 HydrophobicContact CG2-CE3 4.14Å; I427-W429 HydrophobicContact CG2-CG 4.16Å; I427-W429 HydrophobicContact CG2-CH2 4.1Å; I427-W429 HydrophobicContact CG2-CZ2 3.66Å; I427-W429 HydrophobicContact CG2-CZ3 4.32Å; I427-W429 PolarHBondContact O-N 3.05Å; I427-V443 HydrophobicContact CG1-CG1 4.33Å; I427-V443 HydrophobicContact CG1-CG2 4.23Å
428	H	93.6	Very high	91.4	Very high	156 Å²	156	76.2 Å²	76.2	72%	0.722	48%	0.483	S	S	*	.			trans	-72.7	70.7	175.7	-62.5	-70.5	0	0	0	112	L371	L371-H428 WeakPolarHBondContact CD1-O 3.47Å
429	W	95.7	Very high	91.1	Very high	28 Å²	28	80.1 Å²	80.1	11%	0.106	50%	0.501	C	S	.	.			trans	-64.7	142	172.2	-62.6	117.7	0	0	0	111.6	N368 L371 A372 V377 W378 S379 I427 L431 L440	N368-W429 HydrophobicContact CB-CE3 4.02Å; N368-W429 HydrophobicContact CB-CZ3 4.27Å; N368-W429 WeakPolarHBondContact O-CZ3 3.37Å; L371-W429 HydrophobicContact CB-CZ3 4.19Å; L371-W429 HydrophobicContact CD1-CE3 4.15Å; L371-W429 HydrophobicContact CD1-CZ3 4.36Å; L371-W429 HydrophobicContact CD2-CE3 4.46Å; L371-W429 HydrophobicContact CD2-CH2 4.26Å; L371-W429 HydrophobicContact CD2-CZ3 3.97Å; L371-W429 HydrophobicContact CG-CZ3 4.4Å; A372-W429 HydrophobicContact CB-CH2 4.28Å; A372-W429 HydrophobicContact CB-CZ3 4.42Å; V377-W429 HydrophobicContact CG2-CH2 4.14Å; V377-W429 HydrophobicContact CG2-CZ2 4.17Å; W378-W429 AromaticContact CE3-CH2 3.95Å; W378-W429 HydrophobicContact CE3-CH2 3.95Å; W378-W429 HydrophobicContact CE3-CZ3 4.22Å; W378-W429 HydrophobicContact CZ3-CH2 4.41Å; W378-W429 HydrophobicContact CZ3-CZ3 4.22Å; S379-W429 PolarHBondContact OG-NE1 3.45Å; S379-W429 VanDerWaalsContact OG-NE1 3.09Å; I427-W429 HydrophobicContact CB-CD2 4.46Å; I427-W429 HydrophobicContact CB-CZ2 4.29Å; I427-W429 HydrophobicContact CG2-CD2 3.7Å; I427-W429 VanDerWaalsContact CG2-CE2 3.42Å; I427-W429 HydrophobicContact CG2-CE3 4.14Å; I427-W429 HydrophobicContact CG2-CG 4.16Å; I427-W429 HydrophobicContact CG2-CH2 4.1Å; I427-W429 HydrophobicContact CG2-CZ2 3.66Å; I427-W429 HydrophobicContact CG2-CZ3 4.32Å; I427-W429 PolarHBondContact O-N 3.05Å; W429-L431 HydrophobicContact CB-CD2 3.77Å; W429-L431 HydrophobicContact CB-CG 4.33Å; W429-L431 PolarHBondContact O-N 2.8Å; W429-L440 HydrophobicContact CB-CD1 4.33Å; W429-L440 VanDerWaalsContact CD1-CD1 3.47Å; W429-L440 HydrophobicContact CG-CD1 4.02Å
430	V	95.6	Very high	90.8	Very high	61 Å²	61	79.9 Å²	79.9	37%	0.37	50%	0.501	S	S	.	.			trans	-81.9	98	172.7	-174	0	0	0	0	108.3	E367 N368	E367-V430 HydrophobicContact CB-CG2 4.03Å; N368-V430 PolarHBondContact ND2-O 3.11Å; N368-V430 WeakPolarHBondContact OD1-CB 3.24Å; N368-V430 PolarHBondContact OD1-N 3.38Å
431	L	93.1	Very high	90.6	Very high	51 Å²	51	79.6 Å²	79.6	27%	0.267	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-91.7	148	-173.4	-57.2	179.8	0	0	0	112.2	W429 M435 A437 L440	W429-L431 HydrophobicContact CB-CD2 3.77Å; W429-L431 HydrophobicContact CB-CG 4.33Å; W429-L431 PolarHBondContact O-N 2.8Å; L431-M435 HydrophobicContact CB-CB 4.27Å; L431-M435 HydrophobicContact CB-CG 4.32Å; L431-M435 WeakPolarHBondContact CB-O 3.05Å; L431-M435 HydrophobicContact CD1-CG 4.34Å; L431-M435 WeakPolarHBondContact CD1-O 3.36Å; L431-M435 HydrophobicContact CD2-CG 4.41Å; L431-A437 HydrophobicContact CD1-CB 4.32Å; L431-A437 VanDerWaalsContact CD1-N 3.3Å; L431-L440 HydrophobicContact CD2-CD1 3.8Å; L431-L440 HydrophobicContact CD2-CG 4.41Å
432	P	90.6	Very high	90.6	Very high	58 Å²	58	74.5 Å²	74.5	38%	0.377	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-60.3	152.9	168.6	-21.8	33.7	0	0	0	112.3	G434 M435	P432-G434 PolarHBondContact O-N 3.33Å; P432-M435 WeakPolarHBondContact O-CB 3.43Å; P432-M435 PolarHBondContact O-N 3.21Å
433	A	89.6	Confident	90.9	Very high	111 Å²	111	69.8 Å²	69.8	92%	0.917	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	132.4	173.1	0	0	0	0	0	111.4	M435	A433-M435 VanDerWaalsContact C-N 3.35Å
434	G	88.7	Confident	91.5	Very high	83 Å²	83	65.5 Å²	65.5	86%	0.856	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	84	-1.9	-174.4	0	0	0	0	0	115.4	P432 M439	P432-G434 PolarHBondContact O-N 3.33Å; G434-M439 WeakPolarHBondContact O-CE 3.28Å
435	M	91.5	Very high	91.9	Very high	59 Å²	59	68.1 Å²	68.1	29%	0.291	41%	0.41	S	S	.	.			trans	-104.7	124.8	173.1	-177.9	158.3	-81.9	0	0	111.3	L381 L431 P432 A433 M439	L381-M435 HydrophobicContact CD2-CE 3.81Å; L431-M435 HydrophobicContact CB-CB 4.27Å; L431-M435 HydrophobicContact CB-CG 4.32Å; L431-M435 WeakPolarHBondContact CB-O 3.05Å; L431-M435 HydrophobicContact CD1-CG 4.34Å; L431-M435 WeakPolarHBondContact CD1-O 3.36Å; L431-M435 HydrophobicContact CD2-CG 4.41Å; P432-M435 WeakPolarHBondContact O-CB 3.43Å; P432-M435 PolarHBondContact O-N 3.21Å; A433-M435 VanDerWaalsContact C-N 3.35Å; M435-M439 HydrophobicContact CB-CE 4.25Å; M435-M439 HydrophobicContact CE-CE 4.21Å; M435-M439 HydrophobicContact CG-CE 4.19Å
436	S	89.9	Confident	92.4	Very high	62 Å²	62	64.1 Å²	64.1	43%	0.434	38%	0.382	S	S	.	.			trans	-100.2	158.8	173.6	67.2	0	0	0	0	111.1	K438 M439	S436-K438 PolarHBondContact O-N 3.04Å; S436-M439 PolarHBondContact O-N 3.17Å
437	A	89.3	Confident	92.8	Very high	68 Å²	68	61 Å²	61	56%	0.562	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-58.2	-33.2	179.5	0	0	0	0	0	112.4	L431 M439 L440	L431-A437 HydrophobicContact CD1-CB 4.32Å; L431-A437 VanDerWaalsContact CD1-N 3.3Å; A437-M439 PolarHBondContact O-N 3.44Å; A437-M439 VanDerWaalsContact O-N 3.1Å; A437-L440 PolarHBondContact O-N 3.22Å
438	K	86.7	Confident	93	Very high	201 Å²	201	60.9 Å²	60.9	87%	0.874	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-65.3	-6.3	175.4	-60	-167.4	176.8	-166	0	114.9	S436	S436-K438 PolarHBondContact O-N 3.04Å
439	M	89.6	Confident	93.2	Very high	89 Å²	89	54 Å²	54	44%	0.438	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-97.7	-5.3	172.2	-66.7	-151	-67.4	0	0	113.7	L381 G434 M435 S436 A437	L381-M439 WeakPolarHBondContact CD2-O 3.21Å; G434-M439 WeakPolarHBondContact O-CE 3.28Å; M435-M439 HydrophobicContact CB-CE 4.25Å; M435-M439 HydrophobicContact CE-CE 4.21Å; M435-M439 HydrophobicContact CG-CE 4.19Å; S436-M439 PolarHBondContact O-N 3.17Å; A437-M439 PolarHBondContact O-N 3.44Å; A437-M439 VanDerWaalsContact O-N 3.1Å
440	L	90	Very high	93.2	Very high	31 Å²	31	52.8 Å²	52.8	16%	0.162	32%	0.322	C	S	.	.	S	Bend	trans	-84.6	149.2	159.5	-61.9	176.6	0	0	0	108.6	L381 W429 L431 A437	L381-L440 HydrophobicContact CD2-CD2 4.37Å; W429-L440 HydrophobicContact CB-CD1 4.33Å; W429-L440 VanDerWaalsContact CD1-CD1 3.47Å; W429-L440 HydrophobicContact CG-CD1 4.02Å; L431-L440 HydrophobicContact CD2-CD1 3.8Å; L431-L440 HydrophobicContact CD2-CG 4.41Å; A437-L440 PolarHBondContact O-N 3.22Å
441	G	90.7	Very high	93.3	Very high	10 Å²	10	54.4 Å²	54.4	10%	0.103	32%	0.321	C	S	.	.			trans	-77.4	-167	165.1	0	0	0	0	0	111.5	T380 E385	T380-G441 PolarHBondContact O-N 3.16Å; E385-G441 WeakPolarHBondContact OE1-CA 3.47Å
442	G	93.9	Very high	93.5	Very high	3 Å²	3	57.2 Å²	57.2	3%	0.031	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-60.3	170.3	-176.8	0	0	0	0	0	114.9	E385 H421 H422	E385-G442 PolarHBondContact OE1-N 2.71Å; H421-G442 CarbonylContact O-C 3.56Å; H421-G442 WeakPolarHBondContact O-CA 2.96Å; H422-G442 PolarHBondContact NE2-N 3.33Å
443	V	97.1	Very high	93.9	Very high	36 Å²	36	58 Å²	58	22%	0.218	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.9	-179.1	-171.9	0	0	0	0	109.6	V377 H421 I427	V377-V443 HydrophobicContact CB-CG1 3.66Å; V377-V443 HydrophobicContact CG1-CG1 3.85Å; V377-V443 HydrophobicContact CG2-CG1 4.36Å; H421-V443 PolarHBondContact N-O 3.47Å; H421-V443 PolarHBondContact O-N 3.42Å; I427-V443 HydrophobicContact CG1-CG1 4.33Å; I427-V443 HydrophobicContact CG1-CG2 4.23Å
444	F	97.6	Very high	94.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.9	171.5	-67.6	-95.6	0	0	0	110.1	V377 W378 T380 E385 L388 N389 L416 I446	V377-F444 CarbonylContact C-O 3.46Å; V377-F444 VanDerWaalsContact CA-O 3.27Å; V377-F444 WeakPolarHBondContact CA-O 3.11Å; W378-F444 PolarHBondContact N-O 2.94Å; W378-F444 PolarHBondContact O-N 3.13Å; T380-F444 HydrophobicContact CG2-CE2 4.25Å; E385-F444 HydrophobicContact CB-CE2 4.41Å; E385-F444 HydrophobicContact CB-CZ 4.45Å; E385-F444 HydrophobicContact CG-CE2 4.24Å; E385-F444 HydrophobicContact CG-CZ 4.16Å; L388-F444 HydrophobicContact CB-CE1 3.78Å; L388-F444 HydrophobicContact CB-CZ 3.65Å; L388-F444 HydrophobicContact CD1-CE1 4.47Å; L388-F444 HydrophobicContact CD1-CE2 4.24Å; L388-F444 HydrophobicContact CD1-CZ 4.06Å; N389-F444 WeakPolarHBondContact OD1-CE1 3.44Å; N389-F444 WeakPolarHBondContact OD1-CZ 3.36Å; L416-F444 HydrophobicContact CD1-CD1 3.98Å; L416-F444 HydrophobicContact CD1-CE1 4.03Å; L416-F444 HydrophobicContact CD2-CB 3.91Å; L416-F444 HydrophobicContact CD2-CD1 3.58Å; L416-F444 HydrophobicContact CD2-CE1 4.34Å; L416-F444 HydrophobicContact CD2-CG 3.96Å; L416-F444 HydrophobicContact CG-CD1 4.4Å; F444-I446 HydrophobicContact CB-CG2 4.3Å
445	K	97.1	Very high	94.7	Very high	110 Å²	110	51.3 Å²	51.3	48%	0.478	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.3	161.8	-59.6	-178.3	-179.7	179.5	0	107.5	E240 S417 S418	E240-K445 IonicContact OE2-NZ 2.86Å; E240-K445 PolarHBondContact OE2-NZ 3.2Å; S417-K445 PolarHBondContact N-O 3.14Å; S417-K445 VanDerWaalsContact OG-C 3.23Å; S417-K445 PolarHBondContact OG-O 3.48Å; S417-K445 VanDerWaalsContact OG-O 3.11Å; S418-K445 PolarHBondContact N-O 3.12Å; S418-K445 WeakPolarHBondContact OG-CB 3.43Å; S418-K445 PolarHBondContact OG-N 3.29Å
446	I	97.7	Very high	95.1	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.9	-177.7	56.6	161.7	0	0	0	115	G376 W378 L400 F402 A414 R415 L416 S417 F444 W448	G376-I446 VanDerWaalsContact O-CG1 3.3Å; G376-I446 WeakPolarHBondContact O-CG1 3.42Å; G376-I446 PolarHBondContact O-N 2.88Å; W378-I446 HydrophobicContact CB-CD1 4.08Å; L400-I446 HydrophobicContact CD1-CG2 4.25Å; F402-I446 HydrophobicContact CE2-CD1 4.35Å; F402-I446 HydrophobicContact CZ-CD1 4.01Å; A414-I446 HydrophobicContact CB-CB 4.19Å; A414-I446 HydrophobicContact CB-CD1 4.04Å; R415-I446 CarbonylContact O-C 3.58Å; R415-I446 WeakPolarHBondContact O-CA 3.37Å; L416-I446 HydrophobicContact CD2-CG2 3.68Å; S417-I446 PolarHBondContact OG-N 2.78Å; F444-I446 HydrophobicContact CB-CG2 4.3Å; I446-W448 HydrophobicContact CD1-CZ2 4.13Å; I446-W448 PolarHBondContact O-N 3.41Å
447	D	97.3	Very high	95.4	Very high	36 Å²	36	52.9 Å²	52.9	19%	0.193	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	107.6	176.4	-55.9	-11.3	0	0	0	109.5	A414 R415 S417 I449 V504	A414-D447 CarbonylContact C-O 3.5Å; A414-D447 VanDerWaalsContact CA-O 3.28Å; A414-D447 WeakPolarHBondContact CA-O 3.46Å; A414-D447 WeakPolarHBondContact CB-O 3.41Å; R415-D447 IonicContact CZ-OD2 3.67Å; R415-D447 PolarHBondContact N-O 3.08Å; R415-D447 IonicContact NH1-OD2 3.26Å; R415-D447 PolarHBondContact NH1-OD2 3.29Å; R415-D447 PolarHBondContact O-N 3.02Å; S417-D447 WeakPolarHBondContact CB-OD1 3.28Å; S417-D447 PolarHBondContact OG-OD1 3.04Å; D447-I449 PolarHBondContact O-N 3.21Å; D447-V504 HydrophobicContact CB-CG1 4.2Å; D447-V504 HydrophobicContact CB-CG2 4.17Å
448	W	97.8	Very high	95.8	Very high	19 Å²	19	55 Å²	55	7%	0.072	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	131.9	176.2	-77.1	84.9	0	0	0	111.4	V369 A372 K373 F402 A414 I446 R451 I499	V369-W448 HydrophobicContact CG1-CH2 4.39Å; A372-W448 HydrophobicContact CB-CZ2 4.07Å; A372-W448 PolarHBondContact O-NE1 3.18Å; K373-W448 HydrophobicContact CB-CZ2 4.36Å; K373-W448 HydrophobicContact CD-CH2 4.41Å; K373-W448 HydrophobicContact CG-CD2 4.03Å; K373-W448 HydrophobicContact CG-CE3 4.15Å; K373-W448 HydrophobicContact CG-CH2 3.61Å; K373-W448 HydrophobicContact CG-CZ2 3.46Å; K373-W448 VanDerWaalsContact CG-CZ2 3.46Å; K373-W448 HydrophobicContact CG-CZ3 3.96Å; F402-W448 HydrophobicContact CB-CH2 4.47Å; F402-W448 HydrophobicContact CD1-CH2 4.46Å; F402-W448 AromaticContact CD2-CH2 3.49Å; F402-W448 HydrophobicContact CD2-CH2 3.49Å; F402-W448 VanDerWaalsContact CD2-CH2 3.49Å; F402-W448 HydrophobicContact CD2-CZ2 4.24Å; F402-W448 AromaticContact CD2-CZ3 3.92Å; F402-W448 HydrophobicContact CD2-CZ3 3.92Å; F402-W448 AromaticContact CE2-CH2 3.74Å; F402-W448 HydrophobicContact CE2-CH2 3.74Å; F402-W448 HydrophobicContact CE2-CZ2 4.02Å; F402-W448 HydrophobicContact CE2-CZ3 4.33Å; F402-W448 AromaticContact CG-CH2 3.89Å; F402-W448 HydrophobicContact CG-CH2 3.89Å; F402-W448 HydrophobicContact CZ-CH2 4.34Å; F402-W448 HydrophobicContact CZ-CZ2 4.32Å; A414-W448 HydrophobicContact CB-CD2 3.95Å; A414-W448 HydrophobicContact CB-CE3 4.19Å; A414-W448 HydrophobicContact CB-CG 4.13Å; I446-W448 HydrophobicContact CD1-CZ2 4.13Å; I446-W448 PolarHBondContact O-N 3.41Å; W448-R451 HydrophobicContact CB-CG 3.96Å; W448-R451 HydrophobicContact CD2-CG 3.97Å; W448-R451 HydrophobicContact CE3-CG 3.84Å; W448-R451 HydrophobicContact CG-CG 4.03Å; W448-I499 HydrophobicContact CB-CD1 4.32Å; W448-I499 WeakPolarHBondContact O-CG2 3.28Å
449	I	96.9	Very high	96.4	Very high	11 Å²	11	45.5 Å²	45.5	6%	0.056	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-31	177.9	-65.3	167.3	0	0	0	111	L349 V352 I399 F413 R415 D447 L501	L349-I449 HydrophobicContact CD1-CG2 3.68Å; V352-I449 HydrophobicContact CG1-CD1 3.78Å; I399-I449 HydrophobicContact CD1-CD1 4.07Å; F413-I449 HydrophobicContact CD2-CB 3.95Å; F413-I449 HydrophobicContact CD2-CD1 4.38Å; F413-I449 HydrophobicContact CD2-CG2 4.21Å; F413-I449 HydrophobicContact CE2-CB 3.62Å; F413-I449 HydrophobicContact CE2-CD1 4.17Å; F413-I449 HydrophobicContact CE2-CG2 3.36Å; F413-I449 HydrophobicContact CZ-CB 4.24Å; F413-I449 HydrophobicContact CZ-CG2 3.66Å; F413-I449 PolarHBondContact O-N 3.05Å; R415-I449 HydrophobicContact CB-CD1 3.81Å; D447-I449 PolarHBondContact O-N 3.21Å; I449-L501 HydrophobicContact CG2-CD2 3.81Å
450	C	97.6	Very high	96.7	Very high	4 Å²	4	44.1 Å²	44.1	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	120.2	170.9	-174.1	0	0	0	0	109.4	G412 F413 F493 P494	G412-C450 CarbonylContact C-O 3.57Å; G412-C450 WeakPolarHBondContact CA-O 3.36Å; F413-C450 HydrophobicContact CD1-CB 3.78Å; F413-C450 HydrophobicContact CE1-CB 3.5Å; F413-C450 VanDerWaalsContact CE1-CB 3.5Å; F413-C450 HydrophobicContact CZ-CB 4.15Å; F413-C450 PolarHBondContact N-O 3.45Å; F413-C450 PolarHBondContact O-N 3.06Å; F413-C450 VanDerWaalsContact O-N 3.08Å; C450-F493 HydrophobicContact CB-CD1 4.48Å; C450-P494 PolarHBondContact SG-O 3.11Å
451	R	97	Very high	97.1	Very high	94 Å²	94	48.7 Å²	48.7	36%	0.355	25%	0.245	S	C	.	.			trans	-94	-0.6	172.9	-68.5	-179.2	-68.7	-152.6	-2.8	112.1	K373 W448 D496 S498 I499	K373-R451 HydrophobicContact CD-CB 4.21Å; K373-R451 HydrophobicContact CD-CG 4.24Å; K373-R451 HydrophobicContact CG-CG 4.12Å; K373-R451 PolarHBondContact NZ-O 2.73Å; W448-R451 HydrophobicContact CB-CG 3.96Å; W448-R451 HydrophobicContact CD2-CG 3.97Å; W448-R451 HydrophobicContact CE3-CG 3.84Å; W448-R451 HydrophobicContact CG-CG 4.03Å; R451-D496 WeakPolarHBondContact CA-OD2 3.43Å; R451-D496 PolarHBondContact N-OD2 2.98Å; R451-S498 PolarHBondContact NH2-O 2.68Å; R451-S498 PolarHBondContact NH2-OG 3.44Å; R451-I499 HydrophobicContact CB-CD1 4.49Å; R451-I499 HydrophobicContact CG-CD1 4.05Å
452	R	97.6	Very high	97.4	Very high	110 Å²	110	49.1 Å²	49.1	42%	0.415	25%	0.245	S	C	.	.	S	Bend	trans	-82.5	154.4	177.1	-52.7	-177.2	71.3	161.3	11.4	112.2	Q411 F493 P494 P495 D496	Q411-R452 CarbonylContact C-O 3.55Å; R452-F493 WeakPolarHBondContact O-CD1 3.2Å; R452-P494 HydrophobicContact CB-CG 3.76Å; R452-P494 HydrophobicContact CG-CG 4.47Å; R452-P495 WeakPolarHBondContact CD-O 3.42Å; R452-P495 PolarHBondContact NH1-O 3.29Å; R452-D496 HydrophobicContact CG-CB 4.28Å
453	E	97.9	Very high	97.6	Very high	75 Å²	75	52.2 Å²	52.2	35%	0.35	26%	0.263	S	S	.	.			trans	-87.2	149.6	-177.2	-54.4	-165.6	119.8	0	0	114	K409 F410	K409-E453 WeakPolarHBondContact CD-OE1 3.38Å; K409-E453 WeakPolarHBondContact CD-OE2 3.5Å; K409-E453 WeakPolarHBondContact CE-OE1 3.24Å; K409-E453 WeakPolarHBondContact CE-OE2 3.42Å; K409-E453 IonicContact NZ-OE1 3.09Å; K409-E453 PolarHBondContact NZ-OE1 3.25Å; K409-E453 IonicContact NZ-OE2 3.04Å; K409-E453 PolarHBondContact NZ-OE2 3.02Å; F410-E453 CarbonylContact O-C 3.58Å; F410-E453 VanDerWaalsContact O-CA 3.24Å; F410-E453 WeakPolarHBondContact O-CA 3.39Å; F410-E453 WeakPolarHBondContact O-CB 3.42Å
454	L	98.3	Very high	97.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	106.6	173.9	178.5	60.6	0	0	0	110.9	K409 F410 K458 L489 L492 F493	K409-L454 WeakPolarHBondContact CA-O 3.33Å; F410-L454 HydrophobicContact CB-CB 4.32Å; F410-L454 HydrophobicContact CD2-CB 4.25Å; F410-L454 HydrophobicContact CD2-CD2 4.24Å; F410-L454 HydrophobicContact CD2-CG 4.23Å; F410-L454 WeakPolarHBondContact CD2-O 3.42Å; F410-L454 PolarHBondContact N-O 2.75Å; F410-L454 PolarHBondContact O-N 2.71Å; L454-K458 HydrophobicContact CD1-CB 3.74Å; L454-K458 HydrophobicContact CD1-CD 3.6Å; L454-K458 HydrophobicContact CD1-CG 4.3Å; L454-L489 HydrophobicContact CD2-CD1 3.69Å; L454-L492 HydrophobicContact CD1-CB 4.19Å; L454-L492 WeakPolarHBondContact CD1-O 3.24Å; L454-L492 HydrophobicContact CD2-CB 3.77Å; L454-F493 HydrophobicContact CB-CD1 3.68Å; L454-F493 HydrophobicContact CB-CD2 4.3Å; L454-F493 HydrophobicContact CB-CE1 3.52Å; L454-F493 HydrophobicContact CB-CE2 4.19Å; L454-F493 HydrophobicContact CB-CG 4.07Å; L454-F493 HydrophobicContact CB-CZ 3.81Å; L454-F493 HydrophobicContact CD2-CD2 3.61Å; L454-F493 HydrophobicContact CD2-CE1 4.46Å; L454-F493 HydrophobicContact CD2-CE2 3.57Å; L454-F493 HydrophobicContact CD2-CG 4.11Å; L454-F493 HydrophobicContact CD2-CZ 4.02Å
455	P	98.3	Very high	97.7	Very high	53 Å²	53	52.9 Å²	52.9	34%	0.344	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	139.3	175.7	-26.4	35.7	0	0	0	113.3	T457 K458	P455-T457 PolarHBondContact O-N 2.82Å; P455-K458 PolarHBondContact O-N 2.81Å
456	F	98.2	Very high	97.7	Very high	36 Å²	36	54.1 Å²	54.1	16%	0.158	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.2	-179.5	-67.2	-21.3	0	0	0	114.7	S403 G408 K409 F410 K458 S459 A460 K473	S403-F456 WeakPolarHBondContact OG-CZ 3.33Å; G408-F456 WeakPolarHBondContact O-CB 3.4Å; G408-F456 VanDerWaalsContact O-CD2 3.24Å; G408-F456 WeakPolarHBondContact O-CD2 3.46Å; G408-F456 WeakPolarHBondContact O-CG 3.5Å; G408-F456 PolarHBondContact O-N 3.06Å; K409-F456 WeakPolarHBondContact O-CE1 3.24Å; K409-F456 WeakPolarHBondContact O-CZ 3.32Å; F410-F456 HydrophobicContact CD1-CE1 4.17Å; F410-F456 AromaticContact CD2-CD1 3.82Å; F410-F456 HydrophobicContact CD2-CD1 3.82Å; F410-F456 AromaticContact CD2-CE1 3.86Å; F410-F456 HydrophobicContact CD2-CE1 3.86Å; F410-F456 HydrophobicContact CE1-CE1 4.04Å; F410-F456 AromaticContact CE2-CD1 3.54Å; F410-F456 HydrophobicContact CE2-CD1 3.54Å; F410-F456 AromaticContact CE2-CE1 3.74Å; F410-F456 HydrophobicContact CE2-CE1 3.74Å; F410-F456 HydrophobicContact CG-CD1 4.48Å; F410-F456 HydrophobicContact CG-CE1 4.07Å; F410-F456 AromaticContact CZ-CD1 4Å; F410-F456 HydrophobicContact CZ-CD1 4Å; F410-F456 AromaticContact CZ-CE1 3.83Å; F410-F456 HydrophobicContact CZ-CE1 3.83Å; F456-K458 VanDerWaalsContact C-N 3.29Å; F456-S459 PolarHBondContact O-OG 3.43Å; F456-A460 PolarHBondContact O-N 3.45Å; F456-K473 HydrophobicContact CB-CD 3.78Å; F456-K473 HydrophobicContact CD1-CB 3.72Å; F456-K473 HydrophobicContact CD1-CD 4.5Å; F456-K473 HydrophobicContact CD2-CB 4.17Å; F456-K473 HydrophobicContact CD2-CD 3.85Å; F456-K473 HydrophobicContact CE1-CB 3.86Å; F456-K473 HydrophobicContact CE2-CB 4.31Å; F456-K473 HydrophobicContact CG-CB 3.9Å; F456-K473 HydrophobicContact CG-CD 3.81Å; F456-K473 HydrophobicContact CG-CG 4.47Å; F456-K473 HydrophobicContact CZ-CB 4.16Å
457	T	97.9	Very high	97.7	Very high	119 Å²	119	54.8 Å²	54.8	73%	0.73	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-30.8	173.5	50.4	0	0	0	0	112.4	P455	P455-T457 PolarHBondContact O-N 2.82Å
458	K	97.8	Very high	97.7	Very high	113 Å²	113	60 Å²	60	49%	0.491	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-39.1	176.2	-72	179.1	172.9	-179.5	0	112.1	L454 P455 F456 A460 H461	L454-K458 HydrophobicContact CD1-CB 3.74Å; L454-K458 HydrophobicContact CD1-CD 3.6Å; L454-K458 HydrophobicContact CD1-CG 4.3Å; P455-K458 PolarHBondContact O-N 2.81Å; F456-K458 VanDerWaalsContact C-N 3.29Å; K458-A460 VanDerWaalsContact C-N 3.31Å; K458-A460 PolarHBondContact O-N 2.62Å; K458-H461 PolarHBondContact O-CE1 3.47Å; K458-H461 PolarHBondContact O-ND1 3.02Å
459	S	97.6	Very high	97.7	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.007	32%	0.32	C	S	.	.	S	Bend	trans	-85.8	6.1	-179.7	71.5	0	0	0	0	114.3	F456 H461 L462	F456-S459 PolarHBondContact O-OG 3.43Å; S459-H461 PolarHBondContact O-N 3.46Å; S459-H461 VanDerWaalsContact O-N 3.11Å; S459-L462 PolarHBondContact O-N 3.41Å
460	A	96.8	Very high	97.7	Very high	60 Å²	60	67.7 Å²	67.7	50%	0.496	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-18.5	-172	0	0	0	0	0	114.4	F456 K458	F456-A460 PolarHBondContact O-N 3.45Å; K458-A460 VanDerWaalsContact C-N 3.31Å; K458-A460 PolarHBondContact O-N 2.62Å
461	H	97.6	Very high	97.8	Very high	127 Å²	127	70 Å²	70	59%	0.588	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.3	177.5	64.1	-88.3	0	0	0	113.8	K458 S459	K458-H461 PolarHBondContact O-CE1 3.47Å; K458-H461 PolarHBondContact O-ND1 3.02Å; S459-H461 PolarHBondContact O-N 3.46Å; S459-H461 VanDerWaalsContact O-N 3.11Å
462	L	97.9	Very high	97.8	Very high	19 Å²	19	65.6 Å²	65.6	10%	0.099	33%	0.33	C	S	.	.			trans	-94.6	124.5	179.8	-62.2	-179.4	0	0	0	110.8	S459 P471 V472 Q488 L489 L492	S459-L462 PolarHBondContact O-N 3.41Å; L462-P471 CarbonylContact O-C 3.57Å; L462-P471 WeakPolarHBondContact O-CA 3.44Å; L462-V472 HydrophobicContact CB-CB 4.26Å; L462-V472 HydrophobicContact CB-CG1 3.76Å; L462-V472 PolarHBondContact O-N 3.09Å; L462-Q488 HydrophobicContact CD1-CB 4.17Å; L462-Q488 HydrophobicContact CD2-CB 3.88Å; L462-L489 HydrophobicContact CD1-CB 3.79Å; L462-L489 HydrophobicContact CD1-CD1 4.24Å; L462-L492 HydrophobicContact CD1-CD1 3.63Å; L462-L492 HydrophobicContact CG-CD1 4.3Å
463	T	98.2	Very high	97.8	Very high	68 Å²	68	63.9 Å²	63.9	42%	0.417	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.5	174.6	50.9	0	0	0	0	110	P465 H469 K470 C485	T463-P465 WeakPolarHBondContact O-CD 3.48Å; T463-H469 VanDerWaalsContact CB-O 3.24Å; T463-H469 WeakPolarHBondContact CB-O 3.25Å; T463-H469 WeakPolarHBondContact CG2-O 3.2Å; T463-K470 WeakPolarHBondContact CA-O 3.27Å; T463-C485 PolarHBondContact O-SG 3.01Å
464	N	98.3	Very high	97.7	Very high	2 Å²	2	64.2 Å²	64.2	1%	0.011	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	110.9	179.7	-179.9	12.4	0	0	0	110.3	W466 N467 H469 K470 E480 E482	N464-W466 PolarHBondContact O-N 3.11Å; N464-W466 PolarHBondContact OD1-N 2.74Å; N464-W466 VanDerWaalsContact OD1-N 3.09Å; N464-N467 HydrophobicContact CB-CB 4.32Å; N464-N467 CarbonylContact O-C 3.55Å; N464-N467 PolarHBondContact O-N 2.74Å; N464-H469 VanDerWaalsContact O-CA 3.25Å; N464-H469 WeakPolarHBondContact O-CA 3.45Å; N464-H469 PolarHBondContact O-N 3.36Å; N464-K470 PolarHBondContact N-O 2.7Å; N464-E480 PolarHBondContact ND2-O 2.72Å; N464-E482 PolarHBondContact OD1-N 3.33Å
465	P	98.1	Very high	97.6	Very high	48 Å²	48	65.3 Å²	65.3	31%	0.312	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-54.8	-36	175.6	-25.8	35.4	0	0	0	113.1	T463 N467 E468 E482	T463-P465 WeakPolarHBondContact O-CD 3.48Å; P465-N467 PolarHBondContact O-N 2.71Å; P465-E468 PolarHBondContact O-N 2.99Å; P465-E482 HydrophobicContact CG-CB 4.31Å; P465-E482 HydrophobicContact CG-CG 4.19Å
466	W	97.6	Very high	97.5	Very high	136 Å²	136	72.9 Å²	72.9	52%	0.515	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-78.8	8.5	179.6	-56.7	-14	0	0	0	114	N464 Q479 E480 I481 E482	N464-W466 PolarHBondContact O-N 3.11Å; N464-W466 PolarHBondContact OD1-N 2.74Å; N464-W466 VanDerWaalsContact OD1-N 3.09Å; W466-Q479 PolarHBondContact O-NE2 3Å; W466-E480 HydrophobicContact CE3-CB 4.3Å; W466-E480 HydrophobicContact CE3-CG 3.91Å; W466-E480 HydrophobicContact CZ3-CG 3.85Å; W466-I481 WeakPolarHBondContact CZ3-O 3.33Å; W466-E482 HydrophobicContact CD2-CB 3.82Å; W466-E482 HydrophobicContact CD2-CG 4.44Å; W466-E482 HydrophobicContact CE3-CB 4.19Å; W466-E482 HydrophobicContact CG-CB 4.15Å; W466-E482 HydrophobicContact CZ2-CB 4.22Å; W466-E482 HydrophobicContact CZ2-CG 4.1Å
467	N	97.6	Very high	97.5	Very high	20 Å²	20	72.9 Å²	72.9	11%	0.107	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-137.7	56.6	167.5	-170.9	15.5	0	0	0	110.2	N464 P465 H469 K470 I474	N464-N467 HydrophobicContact CB-CB 4.32Å; N464-N467 CarbonylContact O-C 3.55Å; N464-N467 PolarHBondContact O-N 2.74Å; P465-N467 PolarHBondContact O-N 2.71Å; N467-H469 PolarHBondContact O-N 2.91Å; N467-H469 VanDerWaalsContact O-N 3.12Å; N467-K470 WeakPolarHBondContact O-CB 3.32Å; N467-K470 WeakPolarHBondContact O-CD 3.4Å; N467-K470 VanDerWaalsContact O-CG 3.26Å; N467-K470 WeakPolarHBondContact O-CG 3.3Å; N467-K470 PolarHBondContact O-N 2.93Å; N467-I474 PolarHBondContact ND2-O 3.29Å
468	E	97.5	Very high	97.4	Very high	145 Å²	145	67.4 Å²	67.4	68%	0.678	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	30.5	175.4	-59.5	156.2	-113.8	0	0	114.2	P465 K470	P465-E468 PolarHBondContact O-N 2.99Å; E468-K470 HydrophobicContact CB-CD 4.35Å; E468-K470 HydrophobicContact CB-CG 4.39Å; E468-K470 PolarHBondContact O-N 3.01Å; E468-K470 VanDerWaalsContact O-N 3.16Å; E468-K470 IonicContact OE1-NZ 3.96Å; E468-K470 PolarHBondContact OE1-NZ 2.68Å; E468-K470 WeakPolarHBondContact OE2-CE 3.49Å; E468-K470 IonicContact OE2-NZ 2.81Å; E468-K470 PolarHBondContact OE2-NZ 2.83Å
469	H	96.9	Very high	97.4	Very high	122 Å²	122	64 Å²	64	57%	0.565	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.3	24.3	-171.1	-61.4	-90.1	0	0	0	114.6	T463 N464 N467	T463-H469 VanDerWaalsContact CB-O 3.24Å; T463-H469 WeakPolarHBondContact CB-O 3.25Å; T463-H469 WeakPolarHBondContact CG2-O 3.2Å; N464-H469 VanDerWaalsContact O-CA 3.25Å; N464-H469 WeakPolarHBondContact O-CA 3.45Å; N464-H469 PolarHBondContact O-N 3.36Å; N467-H469 PolarHBondContact O-N 2.91Å; N467-H469 VanDerWaalsContact O-N 3.12Å
470	K	98	Very high	97.5	Very high	70 Å²	70	65.6 Å²	65.6	30%	0.304	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	150.8	171.8	-67.2	163.5	-175.4	163.1	0	110.1	T463 N464 N467 E468 V472 I474	T463-K470 WeakPolarHBondContact CA-O 3.27Å; N464-K470 PolarHBondContact N-O 2.7Å; N467-K470 WeakPolarHBondContact O-CB 3.32Å; N467-K470 WeakPolarHBondContact O-CD 3.4Å; N467-K470 VanDerWaalsContact O-CG 3.26Å; N467-K470 WeakPolarHBondContact O-CG 3.3Å; N467-K470 PolarHBondContact O-N 2.93Å; E468-K470 HydrophobicContact CB-CD 4.35Å; E468-K470 HydrophobicContact CB-CG 4.39Å; E468-K470 PolarHBondContact O-N 3.01Å; E468-K470 VanDerWaalsContact O-N 3.16Å; E468-K470 IonicContact OE1-NZ 3.96Å; E468-K470 PolarHBondContact OE1-NZ 2.68Å; E468-K470 WeakPolarHBondContact OE2-CE 3.49Å; E468-K470 IonicContact OE2-NZ 2.81Å; E468-K470 PolarHBondContact OE2-NZ 2.83Å; K470-V472 PolarHBondContact O-N 2.87Å; K470-I474 HydrophobicContact CB-CB 4.34Å; K470-I474 HydrophobicContact CB-CG2 4.41Å; K470-I474 HydrophobicContact CD-CG2 4.44Å
471	P	97.9	Very high	97.5	Very high	51 Å²	51	62.8 Å²	62.8	33%	0.331	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	136.9	177	-25	34.6	0	0	0	111.4	L462 K473 I474	L462-P471 CarbonylContact O-C 3.57Å; L462-P471 WeakPolarHBondContact O-CA 3.44Å; P471-K473 HydrophobicContact CB-CG 4.41Å; P471-K473 PolarHBondContact O-N 2.88Å; P471-I474 VanDerWaalsContact O-CB 3.3Å; P471-I474 WeakPolarHBondContact O-CB 3.38Å; P471-I474 WeakPolarHBondContact O-CG1 3.19Å; P471-I474 PolarHBondContact O-N 3.26Å
472	V	98	Very high	97.6	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-20.7	-165.7	71.5	0	0	0	0	115.3	F410 L462 K470 I474 I481 L489	F410-V472 HydrophobicContact CZ-CG1 4.45Å; L462-V472 HydrophobicContact CB-CB 4.26Å; L462-V472 HydrophobicContact CB-CG1 3.76Å; L462-V472 PolarHBondContact O-N 3.09Å; K470-V472 PolarHBondContact O-N 2.87Å; V472-I474 PolarHBondContact O-N 3.08Å; V472-I481 HydrophobicContact CG2-CD1 3.85Å; V472-I481 HydrophobicContact CG2-CG1 4.25Å; V472-I481 HydrophobicContact CG2-CG2 3.94Å; V472-L489 HydrophobicContact CG1-CD1 4.21Å; V472-L489 HydrophobicContact CG1-CD2 3.95Å; V472-L489 HydrophobicContact CG2-CD2 3.76Å
473	K	96.6	Very high	97.5	Very high	74 Å²	74	61.4 Å²	61.4	32%	0.322	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-19	171.5	69.3	-176.8	-174.3	177.3	0	114.3	K362 F410 F456 P471	K362-K473 PolarHBondContact NZ-O 3.24Å; F410-K473 HydrophobicContact CZ-CB 4.19Å; F456-K473 HydrophobicContact CB-CD 3.78Å; F456-K473 HydrophobicContact CD1-CB 3.72Å; F456-K473 HydrophobicContact CD1-CD 4.5Å; F456-K473 HydrophobicContact CD2-CB 4.17Å; F456-K473 HydrophobicContact CD2-CD 3.85Å; F456-K473 HydrophobicContact CE1-CB 3.86Å; F456-K473 HydrophobicContact CE2-CB 4.31Å; F456-K473 HydrophobicContact CG-CB 3.9Å; F456-K473 HydrophobicContact CG-CD 3.81Å; F456-K473 HydrophobicContact CG-CG 4.47Å; F456-K473 HydrophobicContact CZ-CB 4.16Å; P471-K473 HydrophobicContact CB-CG 4.41Å; P471-K473 PolarHBondContact O-N 2.88Å
474	I	96.8	Very high	97.4	Very high	83 Å²	83	63.1 Å²	63.1	43%	0.426	30%	0.299	S	S	.	.			trans	-94.7	118.8	-178.4	-52.7	-59.3	0	0	0	108.8	N467 K470 P471 V472	N467-I474 PolarHBondContact ND2-O 3.29Å; K470-I474 HydrophobicContact CB-CB 4.34Å; K470-I474 HydrophobicContact CB-CG2 4.41Å; K470-I474 HydrophobicContact CD-CG2 4.44Å; P471-I474 VanDerWaalsContact O-CB 3.3Å; P471-I474 WeakPolarHBondContact O-CB 3.38Å; P471-I474 WeakPolarHBondContact O-CG1 3.19Å; P471-I474 PolarHBondContact O-N 3.26Å; V472-I474 PolarHBondContact O-N 3.08Å
475	G	96.3	Very high	97.4	Very high	22 Å²	22	63.4 Å²	63.4	23%	0.227	30%	0.301	C	S	.	.			trans	175.6	159.6	178.1	0	0	0	0	0	110.6
476	R	96.8	Very high	97.4	Very high	212 Å²	212	61.1 Å²	61.1	80%	0.8	29%	0.286	S	S	*	.			trans	-78.1	171.5	169.3	-65.8	-177	177.3	-176.5	-0.7	110.1	G478 Q479	R476-G478 PolarHBondContact O-N 3.01Å; R476-Q479 VanDerWaalsContact O-CB 3.27Å; R476-Q479 WeakPolarHBondContact O-CB 3.48Å; R476-Q479 PolarHBondContact O-N 3.36Å
477	D	97.3	Very high	97.4	Very high	37 Å²	37	55.6 Å²	55.6	20%	0.198	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	134.4	166.7	-169.1	53.2	0	0	0	110.1	I361 K362 T380 N384 Q479	I361-D477 WeakPolarHBondContact CA-OD1 3.46Å; K362-D477 HydrophobicContact CB-CB 3.99Å; K362-D477 PolarHBondContact N-OD1 2.83Å; T380-D477 PolarHBondContact OG1-OD2 3.16Å; N384-D477 VanDerWaalsContact ND2-C 3.27Å; N384-D477 PolarHBondContact ND2-O 2.62Å; N384-D477 VanDerWaalsContact ND2-O 3.08Å; N384-D477 PolarHBondContact ND2-OD2 3.32Å; D477-Q479 VanDerWaalsContact C-N 3.26Å; D477-Q479 PolarHBondContact O-N 2.96Å
478	G	96.6	Very high	97.4	Very high	4 Å²	4	58.2 Å²	58.2	4%	0.041	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	17.7	-175.9	0	0	0	0	0	114.6	L360 N384 K387 R476 E480	L360-G478 PolarHBondContact O-N 2.96Å; N384-G478 PolarHBondContact ND2-N 3.05Å; K387-G478 PolarHBondContact NZ-O 2.97Å; R476-G478 PolarHBondContact O-N 3.01Å; G478-E480 PolarHBondContact O-N 3.47Å
479	Q	98.3	Very high	97.5	Very high	41 Å²	41	51.3 Å²	51.3	19%	0.192	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	126	168.3	172.2	64.3	58.3	0	0	109.4	F359 L360 W466 R476 D477	F359-Q479 WeakPolarHBondContact CA-O 3.37Å; L360-Q479 HydrophobicContact CB-CB 4.25Å; L360-Q479 PolarHBondContact N-O 2.94Å; W466-Q479 PolarHBondContact O-NE2 3Å; R476-Q479 VanDerWaalsContact O-CB 3.27Å; R476-Q479 WeakPolarHBondContact O-CB 3.48Å; R476-Q479 PolarHBondContact O-N 3.36Å; D477-Q479 VanDerWaalsContact C-N 3.26Å; D477-Q479 PolarHBondContact O-N 2.96Å
480	E	97.9	Very high	97.5	Very high	34 Å²	34	45.6 Å²	45.6	16%	0.159	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	143.2	176.7	-158.7	167.1	170.5	0	0	110.7	R357 F358 F359 N464 W466 G478	R357-E480 IonicContact CZ-OE1 3.44Å; R357-E480 IonicContact CZ-OE2 2.83Å; R357-E480 IonicContact NE-OE1 2.68Å; R357-E480 PolarHBondContact NE-OE1 2.88Å; R357-E480 IonicContact NH2-OE1 3.78Å; R357-E480 PolarHBondContact NH2-OE1 3.16Å; R357-E480 IonicContact NH2-OE2 2.66Å; R357-E480 PolarHBondContact NH2-OE2 3.49Å; F358-E480 CarbonylContact O-C 3.56Å; F358-E480 WeakPolarHBondContact O-CA 3.32Å; F358-E480 WeakPolarHBondContact O-CG 3.47Å; F359-E480 HydrophobicContact CD1-CB 3.99Å; F359-E480 HydrophobicContact CD1-CG 3.99Å; F359-E480 HydrophobicContact CE1-CB 3.72Å; F359-E480 HydrophobicContact CE1-CG 3.5Å; F359-E480 WeakPolarHBondContact CE1-OE2 3.43Å; F359-E480 HydrophobicContact CE2-CG 4.43Å; F359-E480 HydrophobicContact CZ-CB 4.46Å; F359-E480 VanDerWaalsContact CZ-CD 3.47Å; F359-E480 HydrophobicContact CZ-CG 3.76Å; N464-E480 PolarHBondContact ND2-O 2.72Å; W466-E480 HydrophobicContact CE3-CB 4.3Å; W466-E480 HydrophobicContact CE3-CG 3.91Å; W466-E480 HydrophobicContact CZ3-CG 3.85Å; G478-E480 PolarHBondContact O-N 3.47Å
481	I	98.4	Very high	97.5	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.5	-179.3	-56.3	166.5	0	0	0	108.5	F358 L360 I401 W466 V472 C485	F358-I481 HydrophobicContact CB-CB 3.9Å; F358-I481 PolarHBondContact O-N 3.19Å; L360-I481 HydrophobicContact CB-CD1 4.15Å; I401-I481 HydrophobicContact CD1-CD1 4.27Å; W466-I481 WeakPolarHBondContact CZ3-O 3.33Å; V472-I481 HydrophobicContact CG2-CD1 3.85Å; V472-I481 HydrophobicContact CG2-CG1 4.25Å; V472-I481 HydrophobicContact CG2-CG2 3.94Å; I481-C485 HydrophobicContact CG2-CB 3.87Å
482	E	98	Very high	97.4	Very high	44 Å²	44	44.4 Å²	44.4	21%	0.206	21%	0.214	C	C	.	.			trans	-58.6	148.8	177.3	-176.8	-77.7	132.6	0	0	112.3	N464 P465 W466 E484 C485 G486	N464-E482 PolarHBondContact OD1-N 3.33Å; P465-E482 HydrophobicContact CG-CB 4.31Å; P465-E482 HydrophobicContact CG-CG 4.19Å; W466-E482 HydrophobicContact CD2-CB 3.82Å; W466-E482 HydrophobicContact CD2-CG 4.44Å; W466-E482 HydrophobicContact CE3-CB 4.19Å; W466-E482 HydrophobicContact CG-CB 4.15Å; W466-E482 HydrophobicContact CZ2-CB 4.22Å; W466-E482 HydrophobicContact CZ2-CG 4.1Å; E482-E484 VanDerWaalsContact CD-N 3.29Å; E482-E484 PolarHBondContact O-N 3.27Å; E482-E484 PolarHBondContact OE1-N 3.44Å; E482-E484 PolarHBondContact OE2-N 2.7Å; E482-C485 HydrophobicContact CB-CB 4.26Å; E482-C485 PolarHBondContact O-N 2.96Å; E482-C485 WeakPolarHBondContact OE2-CB 3.39Å; E482-C485 PolarHBondContact OE2-N 3.08Å; E482-G486 PolarHBondContact O-N 3.45Å
483	L	96.6	Very high	97.4	Very high	72 Å²	72	45.1 Å²	45.1	38%	0.377	22%	0.217	S	C	.	.	H	α-helix	trans	-52.8	-53	-171	178.1	72.3	0	0	0	113.8	A356 F358 T487	A356-L483 VanDerWaalsContact O-CD1 3.24Å; A356-L483 WeakPolarHBondContact O-CD1 3.37Å; F358-L483 HydrophobicContact CE2-CD1 4.24Å; F358-L483 WeakPolarHBondContact CE2-O 3.47Å; L483-T487 VanDerWaalsContact O-CB 3.24Å; L483-T487 WeakPolarHBondContact O-CB 3.24Å; L483-T487 PolarHBondContact O-N 2.85Å; L483-T487 PolarHBondContact O-OG1 3.29Å
484	E	97.1	Very high	97.3	Very high	104 Å²	104	43.2 Å²	43.2	49%	0.486	21%	0.212	S	C	.	.	H	α-helix	trans	-69.1	-45.3	-179.1	-174.8	63.1	-145.1	0	0	110.4	E482 G486 T487 Q488	E482-E484 VanDerWaalsContact CD-N 3.29Å; E482-E484 PolarHBondContact O-N 3.27Å; E482-E484 PolarHBondContact OE1-N 3.44Å; E482-E484 PolarHBondContact OE2-N 2.7Å; E484-G486 PolarHBondContact O-N 2.88Å; E484-T487 PolarHBondContact O-N 3.31Å; E484-Q488 HydrophobicContact CG-CG 4.48Å; E484-Q488 WeakPolarHBondContact O-CG 3.16Å; E484-Q488 PolarHBondContact O-N 2.71Å; E484-Q488 WeakPolarHBondContact OE1-CG 3.39Å; E484-Q488 PolarHBondContact OE1-NE2 3.46Å
485	C	98	Very high	97.1	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.054	21%	0.206	C	C	.	.	H	α-helix	trans	-55.5	-47.5	176.2	-171.6	0	0	0	0	112.7	T463 I481 E482 L489	T463-C485 PolarHBondContact O-SG 3.01Å; I481-C485 HydrophobicContact CG2-CB 3.87Å; E482-C485 HydrophobicContact CB-CB 4.26Å; E482-C485 PolarHBondContact O-N 2.96Å; E482-C485 WeakPolarHBondContact OE2-CB 3.39Å; E482-C485 PolarHBondContact OE2-N 3.08Å; C485-L489 WeakPolarHBondContact O-CB 3.48Å; C485-L489 PolarHBondContact O-N 3.03Å
486	G	97.8	Very high	96.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-69.1	-39.1	178	0	0	0	0	0	112.9	E482 E484 L489 C490	E482-G486 PolarHBondContact O-N 3.45Å; E484-G486 PolarHBondContact O-N 2.88Å; G486-L489 PolarHBondContact O-N 3.44Å; G486-C490 PolarHBondContact O-N 3.05Å; G486-C490 PolarHBondContact O-SG 3.11Å
487	T	97.8	Very high	96.6	Very high	20 Å²	20	38.5 Å²	38.5	12%	0.123	20%	0.196	C	C	.	.	H	α-helix	trans	-63.5	-47.2	176.2	-61.6	0	0	0	0	111.3	L353 F358 L483 E484 L489 C490 L491	L353-T487 HydrophobicContact CD1-CG2 4.35Å; F358-T487 WeakPolarHBondContact CZ-OG1 3.38Å; L483-T487 VanDerWaalsContact O-CB 3.24Å; L483-T487 WeakPolarHBondContact O-CB 3.24Å; L483-T487 PolarHBondContact O-N 2.85Å; L483-T487 PolarHBondContact O-OG1 3.29Å; E484-T487 PolarHBondContact O-N 3.31Å; T487-L489 VanDerWaalsContact C-N 3.35Å; T487-L489 PolarHBondContact O-N 2.86Å; T487-C490 PolarHBondContact O-N 3.35Å; T487-L491 HydrophobicContact CG2-CD1 4.01Å; T487-L491 VanDerWaalsContact O-CG 3.29Å; T487-L491 WeakPolarHBondContact O-CG 3.22Å; T487-L491 PolarHBondContact O-N 3.12Å
488	Q	97.9	Very high	96.3	Very high	76 Å²	76	40.1 Å²	40.1	36%	0.355	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-38.9	175.8	-64.7	-60.9	-21.2	0	0	111.6	L462 E484 C490 L491 L492	L462-Q488 HydrophobicContact CD1-CB 4.17Å; L462-Q488 HydrophobicContact CD2-CB 3.88Å; E484-Q488 HydrophobicContact CG-CG 4.48Å; E484-Q488 WeakPolarHBondContact O-CG 3.16Å; E484-Q488 PolarHBondContact O-N 2.71Å; E484-Q488 WeakPolarHBondContact OE1-CG 3.39Å; E484-Q488 PolarHBondContact OE1-NE2 3.46Å; Q488-C490 PolarHBondContact O-N 3.44Å; Q488-L491 PolarHBondContact O-N 3.35Å; Q488-L492 WeakPolarHBondContact O-CG 3.37Å; Q488-L492 PolarHBondContact O-N 3.44Å
489	L	98.3	Very high	96.1	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-45.1	175.6	-179.6	57.2	0	0	0	111.9	I401 F410 L454 L462 V472 C485 G486 T487 L491 L492 F493	I401-L489 HydrophobicContact CD1-CD2 3.76Å; I401-L489 HydrophobicContact CD1-CG 4.24Å; I401-L489 HydrophobicContact CG2-CD2 4.16Å; F410-L489 HydrophobicContact CD2-CD1 4.29Å; F410-L489 HydrophobicContact CE1-CD2 4.18Å; F410-L489 HydrophobicContact CE2-CD1 3.77Å; F410-L489 HydrophobicContact CE2-CD2 4.37Å; F410-L489 HydrophobicContact CZ-CD1 4.14Å; F410-L489 HydrophobicContact CZ-CD2 3.93Å; L454-L489 HydrophobicContact CD2-CD1 3.69Å; L462-L489 HydrophobicContact CD1-CB 3.79Å; L462-L489 HydrophobicContact CD1-CD1 4.24Å; V472-L489 HydrophobicContact CG1-CD1 4.21Å; V472-L489 HydrophobicContact CG1-CD2 3.95Å; V472-L489 HydrophobicContact CG2-CD2 3.76Å; C485-L489 WeakPolarHBondContact O-CB 3.48Å; C485-L489 PolarHBondContact O-N 3.03Å; G486-L489 PolarHBondContact O-N 3.44Å; T487-L489 VanDerWaalsContact C-N 3.35Å; T487-L489 PolarHBondContact O-N 2.86Å; L489-L491 VanDerWaalsContact C-N 3.31Å; L489-L491 PolarHBondContact O-N 3.42Å; L489-L492 PolarHBondContact O-N 3.32Å; L489-F493 HydrophobicContact CG-CE2 4.48Å; L489-F493 VanDerWaalsContact O-CD2 3.28Å; L489-F493 WeakPolarHBondContact O-CD2 3.35Å
490	C	97.9	Very high	95.8	Very high	1 Å²	1	43 Å²	43	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-34.3	176.6	-66.4	0	0	0	0	112.5	L353 F413 G486 T487 Q488 L492 F493	L353-C490 HydrophobicContact CD1-CB 3.56Å; F413-C490 HydrophobicContact CD2-CB 4.48Å; F413-C490 HydrophobicContact CE1-CB 4.06Å; F413-C490 HydrophobicContact CE2-CB 3.95Å; F413-C490 HydrophobicContact CZ-CB 3.73Å; G486-C490 PolarHBondContact O-N 3.05Å; G486-C490 PolarHBondContact O-SG 3.11Å; T487-C490 PolarHBondContact O-N 3.35Å; Q488-C490 PolarHBondContact O-N 3.44Å; C490-L492 VanDerWaalsContact C-N 3.28Å; C490-L492 PolarHBondContact O-N 3.05Å; C490-F493 PolarHBondContact O-N 3.37Å
491	L	96.8	Very high	95.4	Very high	44 Å²	44	42.3 Å²	42.3	23%	0.23	22%	0.223	C	C	.	.	H	α-helix	trans	-72.7	-13.5	175.9	-70.1	167.6	0	0	0	114.3	L349 K350 T487 Q488 L489	L349-L491 HydrophobicContact CD2-CD2 4.09Å; K350-L491 HydrophobicContact CG-CD2 4.31Å; T487-L491 HydrophobicContact CG2-CD1 4.01Å; T487-L491 VanDerWaalsContact O-CG 3.29Å; T487-L491 WeakPolarHBondContact O-CG 3.22Å; T487-L491 PolarHBondContact O-N 3.12Å; Q488-L491 PolarHBondContact O-N 3.35Å; L489-L491 VanDerWaalsContact C-N 3.31Å; L489-L491 PolarHBondContact O-N 3.42Å
492	L	97.3	Very high	95.1	Very high	53 Å²	53	48.2 Å²	48.2	28%	0.277	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-15.2	174.6	-71	173.4	0	0	0	113.8	L454 L462 Q488 L489 C490	L454-L492 HydrophobicContact CD1-CB 4.19Å; L454-L492 WeakPolarHBondContact CD1-O 3.24Å; L454-L492 HydrophobicContact CD2-CB 3.77Å; L462-L492 HydrophobicContact CD1-CD1 3.63Å; L462-L492 HydrophobicContact CG-CD1 4.3Å; Q488-L492 WeakPolarHBondContact O-CG 3.37Å; Q488-L492 PolarHBondContact O-N 3.44Å; L489-L492 PolarHBondContact O-N 3.32Å; C490-L492 VanDerWaalsContact C-N 3.28Å; C490-L492 PolarHBondContact O-N 3.05Å
493	F	97.6	Very high	94.8	Very high	17 Å²	17	51.6 Å²	51.6	8%	0.075	26%	0.262	C	S	.	.	S	Bend	trans	-66	144.1	175.5	-77.2	-99.8	0	0	0	110.6	I401 F410 F413 C450 R452 L454 L489 C490	I401-F493 HydrophobicContact CG2-CZ 4.31Å; F410-F493 HydrophobicContact CB-CE1 4.09Å; F410-F493 HydrophobicContact CB-CZ 3.68Å; F410-F493 HydrophobicContact CG-CZ 4.29Å; F413-F493 HydrophobicContact CD1-CD1 4.14Å; F413-F493 AromaticContact CD1-CD2 3.64Å; F413-F493 HydrophobicContact CD1-CD2 3.64Å; F413-F493 HydrophobicContact CD1-CE1 4.2Å; F413-F493 AromaticContact CD1-CE2 3.68Å; F413-F493 HydrophobicContact CD1-CE2 3.68Å; F413-F493 AromaticContact CD1-CG 3.87Å; F413-F493 HydrophobicContact CD1-CG 3.87Å; F413-F493 AromaticContact CD1-CZ 3.97Å; F413-F493 HydrophobicContact CD1-CZ 3.97Å; F413-F493 HydrophobicContact CE1-CB 3.97Å; F413-F493 HydrophobicContact CE1-CD1 4.35Å; F413-F493 AromaticContact CE1-CD2 3.62Å; F413-F493 HydrophobicContact CE1-CD2 3.62Å; F413-F493 HydrophobicContact CE1-CE2 4.15Å; F413-F493 AromaticContact CE1-CG 3.73Å; F413-F493 HydrophobicContact CE1-CG 3.73Å; C450-F493 HydrophobicContact CB-CD1 4.48Å; R452-F493 WeakPolarHBondContact O-CD1 3.2Å; L454-F493 HydrophobicContact CB-CD1 3.68Å; L454-F493 HydrophobicContact CB-CD2 4.3Å; L454-F493 HydrophobicContact CB-CE1 3.52Å; L454-F493 HydrophobicContact CB-CE2 4.19Å; L454-F493 HydrophobicContact CB-CG 4.07Å; L454-F493 HydrophobicContact CB-CZ 3.81Å; L454-F493 HydrophobicContact CD2-CD2 3.61Å; L454-F493 HydrophobicContact CD2-CE1 4.46Å; L454-F493 HydrophobicContact CD2-CE2 3.57Å; L454-F493 HydrophobicContact CD2-CG 4.11Å; L454-F493 HydrophobicContact CD2-CZ 4.02Å; L489-F493 HydrophobicContact CG-CE2 4.48Å; L489-F493 VanDerWaalsContact O-CD2 3.28Å; L489-F493 WeakPolarHBondContact O-CD2 3.35Å; C490-F493 PolarHBondContact O-N 3.37Å
494	P	95.1	Very high	94.5	Very high	33 Å²	33	48.7 Å²	48.7	21%	0.214	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-65.6	145.9	169.9	30.2	-33.3	0	0	0	109.8	C450 R452 D496	C450-P494 PolarHBondContact SG-O 3.11Å; R452-P494 HydrophobicContact CB-CG 3.76Å; R452-P494 HydrophobicContact CG-CG 4.47Å; P494-D496 PolarHBondContact O-N 2.84Å
495	P	91.1	Very high	94.3	Very high	46 Å²	46	44.5 Å²	44.5	30%	0.299	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-59	137.9	178.9	26.1	-34.6	0	0	0	110.2	R452	R452-P495 WeakPolarHBondContact CD-O 3.42Å; R452-P495 PolarHBondContact NH1-O 3.29Å
496	D	92.9	Very high	93.9	Very high	20 Å²	20	48.5 Å²	48.5	11%	0.107	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-95.2	125.9	173.1	-153.2	-35.9	0	0	0	108.6	R451 R452 P494 S498 I499	R451-D496 WeakPolarHBondContact CA-OD2 3.43Å; R451-D496 PolarHBondContact N-OD2 2.98Å; R452-D496 HydrophobicContact CG-CB 4.28Å; P494-D496 PolarHBondContact O-N 2.84Å; D496-S498 WeakPolarHBondContact OD1-CB 3.41Å; D496-S498 PolarHBondContact OD1-N 3.1Å; D496-S498 PolarHBondContact OD1-OG 2.97Å; D496-I499 HydrophobicContact CB-CD1 3.95Å; D496-I499 HydrophobicContact CB-CG1 4.31Å; D496-I499 WeakPolarHBondContact OD2-CD1 3.38Å
497	E	90.4	Very high	93.5	Very high	153 Å²	153	53.7 Å²	53.7	72%	0.715	27%	0.268	S	S	*	.	S	Bend	trans	-94.3	-7.7	-179.6	-71.4	160	-155.6	0	0	110.8
498	S	91.3	Very high	92.9	Very high	71 Å²	71	53.1 Å²	53.1	50%	0.497	27%	0.265	S	S	.	.	S	Bend	trans	-91.6	11.2	178.7	72.4	0	0	0	0	114.4	R451 D496	R451-S498 PolarHBondContact NH2-O 2.68Å; R451-S498 PolarHBondContact NH2-OG 3.44Å; D496-S498 WeakPolarHBondContact OD1-CB 3.41Å; D496-S498 PolarHBondContact OD1-N 3.1Å; D496-S498 PolarHBondContact OD1-OG 2.97Å
499	I	92.2	Very high	92.3	Very high	33 Å²	33	55.2 Å²	55.2	17%	0.169	27%	0.269	C	S	.	.			trans	-143.5	122.5	-169.6	-58.6	175.6	0	0	0	109	W448 R451 D496	W448-I499 HydrophobicContact CB-CD1 4.32Å; W448-I499 WeakPolarHBondContact O-CG2 3.28Å; R451-I499 HydrophobicContact CB-CD1 4.49Å; R451-I499 HydrophobicContact CG-CD1 4.05Å; D496-I499 HydrophobicContact CB-CD1 3.95Å; D496-I499 HydrophobicContact CB-CG1 4.31Å; D496-I499 WeakPolarHBondContact OD2-CD1 3.38Å
500	D	91.3	Very high	91.3	Very high	73 Å²	73	58.1 Å²	58.1	39%	0.39	28%	0.283	S	S	.	.			trans	-92.1	115.5	168.3	-169.4	11.5	0	0	0	112.4	K348 Y502 Q503	K348-D500 IonicContact NZ-OD1 3.9Å; K348-D500 PolarHBondContact NZ-OD1 2.79Å; D500-Y502 VanDerWaalsContact CG-N 3.32Å; D500-Y502 PolarHBondContact O-N 2.91Å; D500-Y502 VanDerWaalsContact O-N 3.16Å; D500-Y502 WeakPolarHBondContact OD1-CB 3.29Å; D500-Y502 PolarHBondContact OD1-N 3.02Å; D500-Y502 WeakPolarHBondContact OD2-CB 3.45Å; D500-Q503 PolarHBondContact O-N 2.83Å
501	L	90.9	Very high	90	Very high	19 Å²	19	63.4 Å²	63.4	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-19.8	168.7	-78.3	166.4	0	0	0	113.8	K348 L349 V352 I449 I505	K348-L501 HydrophobicContact CB-CB 4.06Å; K348-L501 HydrophobicContact CB-CD1 3.88Å; K348-L501 HydrophobicContact CD-CB 3.81Å; L349-L501 HydrophobicContact CB-CD1 4.18Å; L349-L501 HydrophobicContact CD1-CD2 4.44Å; V352-L501 HydrophobicContact CG2-CD2 4.41Å; I449-L501 HydrophobicContact CG2-CD2 3.81Å; L501-I505 WeakPolarHBondContact O-CB 3.43Å; L501-I505 WeakPolarHBondContact O-CD1 3.4Å; L501-I505 WeakPolarHBondContact O-CG1 3.3Å; L501-I505 PolarHBondContact O-N 2.94Å
502	Y	91.4	Very high	88.7	Confident	125 Å²	125	67.9 Å²	67.9	49%	0.49	32%	0.319	S	S	.	.	H	α-helix	trans	-67.2	-45.2	177.6	-165.3	-86.8	0	0	0	112.1	D500 V504 I505 H506	D500-Y502 VanDerWaalsContact CG-N 3.32Å; D500-Y502 PolarHBondContact O-N 2.91Å; D500-Y502 VanDerWaalsContact O-N 3.16Å; D500-Y502 WeakPolarHBondContact OD1-CB 3.29Å; D500-Y502 PolarHBondContact OD1-N 3.02Å; D500-Y502 WeakPolarHBondContact OD2-CB 3.45Å; Y502-V504 VanDerWaalsContact C-N 3.35Å; Y502-V504 PolarHBondContact O-N 3.43Å; Y502-I505 CarbonylContact O-C 3.45Å; Y502-I505 WeakPolarHBondContact O-CA 3.34Å; Y502-I505 WeakPolarHBondContact O-CB 3.09Å; Y502-I505 PolarHBondContact O-N 2.98Å; Y502-I505 VanDerWaalsContact O-N 3.07Å; Y502-H506 PolarHBondContact O-N 2.89Å
503	Q	91.3	Very high	87.3	Confident	116 Å²	116	73.2 Å²	73.2	54%	0.542	34%	0.336	S	S	.	.	H	α-helix	trans	-57	-48.2	177.7	-69.4	174.3	-29.1	0	0	111.1	D500 I505 H506 K507	D500-Q503 PolarHBondContact O-N 2.83Å; Q503-I505 VanDerWaalsContact C-N 3.31Å; Q503-I505 PolarHBondContact O-N 3.42Å; Q503-H506 WeakPolarHBondContact O-CA 3.36Å; Q503-H506 WeakPolarHBondContact O-CB 3.43Å; Q503-H506 PolarHBondContact O-N 2.72Å; Q503-K507 PolarHBondContact O-N 3Å
504	V	91.4	Very high	85	Confident	10 Å²	10	78.5 Å²	78.5	6%	0.061	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-42.7	175	-170.8	0	0	0	0	111.2	D447 Y502 H506 M508	D447-V504 HydrophobicContact CB-CG1 4.2Å; D447-V504 HydrophobicContact CB-CG2 4.17Å; Y502-V504 VanDerWaalsContact C-N 3.35Å; Y502-V504 PolarHBondContact O-N 3.43Å; V504-H506 VanDerWaalsContact C-N 3.3Å; V504-H506 PolarHBondContact O-N 3.29Å; V504-M508 VanDerWaalsContact O-CB 3.29Å; V504-M508 WeakPolarHBondContact O-CB 3.46Å; V504-M508 WeakPolarHBondContact O-CG 3Å; V504-M508 PolarHBondContact O-N 2.9Å
505	I	92.5	Very high	83.3	Confident	17 Å²	17	84.3 Å²	84.3	9%	0.087	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-31.5	175	-74.4	168.9	0	0	0	112	K348 Y351 V352 L501 Y502 Q503 R509	K348-I505 HydrophobicContact CB-CD1 3.97Å; K348-I505 HydrophobicContact CG-CD1 4.18Å; Y351-I505 HydrophobicContact CD1-CD1 4.04Å; Y351-I505 HydrophobicContact CD1-CG1 4.04Å; Y351-I505 HydrophobicContact CD1-CG2 4.33Å; Y351-I505 HydrophobicContact CE1-CG1 4.42Å; Y351-I505 HydrophobicContact CE1-CG2 3.98Å; V352-I505 HydrophobicContact CG2-CD1 3.98Å; V352-I505 HydrophobicContact CG2-CG1 3.5Å; V352-I505 VanDerWaalsContact CG2-CG1 3.5Å; L501-I505 WeakPolarHBondContact O-CB 3.43Å; L501-I505 WeakPolarHBondContact O-CD1 3.4Å; L501-I505 WeakPolarHBondContact O-CG1 3.3Å; L501-I505 PolarHBondContact O-N 2.94Å; Y502-I505 CarbonylContact O-C 3.45Å; Y502-I505 WeakPolarHBondContact O-CA 3.34Å; Y502-I505 WeakPolarHBondContact O-CB 3.09Å; Y502-I505 PolarHBondContact O-N 2.98Å; Y502-I505 VanDerWaalsContact O-N 3.07Å; Q503-I505 VanDerWaalsContact C-N 3.31Å; Q503-I505 PolarHBondContact O-N 3.42Å; I505-R509 WeakPolarHBondContact O-CB 3.47Å; I505-R509 WeakPolarHBondContact O-CD 3.39Å; I505-R509 WeakPolarHBondContact O-CG 3.37Å; I505-R509 PolarHBondContact O-N 3Å
506	H	90	Very high	81.5	Confident	92 Å²	92	85.6 Å²	85.6	43%	0.426	40%	0.396	S	S	.	.	H	α-helix	trans	-70.9	-55.1	177.7	-160.5	-122.6	0	0	0	110.7	Y502 Q503 V504 M508 R509 H510	Y502-H506 PolarHBondContact O-N 2.89Å; Q503-H506 WeakPolarHBondContact O-CA 3.36Å; Q503-H506 WeakPolarHBondContact O-CB 3.43Å; Q503-H506 PolarHBondContact O-N 2.72Å; V504-H506 VanDerWaalsContact C-N 3.3Å; V504-H506 PolarHBondContact O-N 3.29Å; H506-M508 VanDerWaalsContact C-N 3.26Å; H506-M508 PolarHBondContact O-N 3.13Å; H506-R509 CarbonylContact O-C 3.57Å; H506-R509 WeakPolarHBondContact O-CA 3.24Å; H506-R509 PolarHBondContact O-N 2.86Å; H506-H510 PolarHBondContact O-N 2.87Å
507	K	87.5	Confident	79.3	Confident	108 Å²	108	92.9 Å²	92.9	47%	0.47	43%	0.429	S	S	.	.	H	α-helix	trans	-60.3	-34.7	178	-55.9	-156	-179.2	-139	0	111.5	E247 Q503 R509 H510 K511	E247-K507 IonicContact OE1-NZ 2.7Å; E247-K507 PolarHBondContact OE1-NZ 3.43Å; Q503-K507 PolarHBondContact O-N 3Å; K507-R509 PolarHBondContact O-N 2.89Å; K507-H510 PolarHBondContact O-N 2.82Å; K507-K511 PolarHBondContact O-N 2.85Å
508	M	87	Confident	77.4	Confident	9 Å²	9	91.6 Å²	91.6	4%	0.044	43%	0.434	C	S	.	.	H	α-helix	trans	-62.4	-30.9	168.8	-80.3	-176.7	77.8	0	0	115.4	V352 R396 S397 R415 V504 H506 R512	V352-M508 HydrophobicContact CB-SD 4.3Å; V352-M508 HydrophobicContact CG1-SD 3.91Å; V352-M508 HydrophobicContact CG2-SD 4.08Å; R396-M508 HydrophobicContact CG-CE 3.86Å; S397-M508 WeakPolarHBondContact OG-CE 3.43Å; R415-M508 VanDerWaalsContact CZ-CG 3.41Å; V504-M508 VanDerWaalsContact O-CB 3.29Å; V504-M508 WeakPolarHBondContact O-CB 3.46Å; V504-M508 WeakPolarHBondContact O-CG 3Å; V504-M508 PolarHBondContact O-N 2.9Å; H506-M508 VanDerWaalsContact C-N 3.26Å; H506-M508 PolarHBondContact O-N 3.13Å; M508-R512 WeakPolarHBondContact O-CD 3.2Å; M508-R512 WeakPolarHBondContact O-CG 3.36Å
509	R	84.5	Confident	75.5	Confident	119 Å²	119	99.3 Å²	99.3	45%	0.449	45%	0.453	S	S	.	.	H	α-helix	trans	-89.1	-29	179.8	-71.9	169.6	83.6	-157	6.6	111.7	I505 H506 K507	I505-R509 WeakPolarHBondContact O-CB 3.47Å; I505-R509 WeakPolarHBondContact O-CD 3.39Å; I505-R509 WeakPolarHBondContact O-CG 3.37Å; I505-R509 PolarHBondContact O-N 3Å; H506-R509 CarbonylContact O-C 3.57Å; H506-R509 WeakPolarHBondContact O-CA 3.24Å; H506-R509 PolarHBondContact O-N 2.86Å; K507-R509 PolarHBondContact O-N 2.89Å
510	H	76.1	Confident	73.4	Confident	62 Å²	62	103.1 Å²	103.1	29%	0.287	48%	0.482	S	S	.	.	H	α-helix	trans	-66.6	-63.7	174.1	-160.1	145.7	0	0	0	110.6	E243 H506 K507 R512 R513 M514	E243-H510 IonicContact OE1-CE1 3.27Å; H506-H510 PolarHBondContact O-N 2.87Å; K507-H510 PolarHBondContact O-N 2.82Å; H510-R512 PolarHBondContact O-N 3.26Å; H510-R513 WeakPolarHBondContact O-CB 3.45Å; H510-R513 PolarHBondContact O-N 3.04Å; H510-M514 PolarHBondContact O-N 2.88Å
511	K	71.4	Confident	71.5	Confident	111 Å²	111	111.7 Å²	111.7	48%	0.483	51%	0.509	S	S	.	.	H	α-helix	trans	-55.5	-30.5	-176.8	-64.9	-150.9	170.9	-156.4	0	113.3	K507 R513 M514 H515	K507-K511 PolarHBondContact O-N 2.85Å; K511-R513 VanDerWaalsContact C-N 3.34Å; K511-R513 PolarHBondContact O-N 2.91Å; K511-M514 PolarHBondContact O-N 3.23Å; K511-H515 WeakPolarHBondContact O-CB 3.33Å; K511-H515 PolarHBondContact O-N 3.42Å; K511-H515 PolarHBondContact O-ND1 3.37Å
512	R	68.6	Low	69.2	Low	139 Å²	139	113.7 Å²	113.7	53%	0.525	53%	0.534	S	S	.	.	H	α-helix	trans	-67.2	-21.7	173	-83.8	-175.4	158.9	-138.7	-14.6	116	M508 H510 S516	M508-R512 WeakPolarHBondContact O-CD 3.2Å; M508-R512 WeakPolarHBondContact O-CG 3.36Å; H510-R512 PolarHBondContact O-N 3.26Å; R512-S516 PolarHBondContact O-OG 2.83Å
513	R	68.6	Low	67	Low	164 Å²	164	117.3 Å²	117.3	62%	0.619	55%	0.547	S	S	*	.	H	α-helix	trans	-78	-49.4	172.4	-73.8	171.3	170.5	173.5	-3	110.3	H510 K511 S516	H510-R513 WeakPolarHBondContact O-CB 3.45Å; H510-R513 PolarHBondContact O-N 3.04Å; K511-R513 VanDerWaalsContact C-N 3.34Å; K511-R513 PolarHBondContact O-N 2.91Å; R513-S516 PolarHBondContact O-N 3.42Å; R513-S516 VanDerWaalsContact O-N 3.11Å; R513-S516 VanDerWaalsContact O-O 3.08Å; R513-S516 PolarHBondContact O-OG 3.4Å
514	M	48.9	Very low	64.7	Low	128 Å²	128	118.1 Å²	118.1	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-65.8	-45.9	-178	-53.1	-39.6	-141.1	0	0	111.6	H510 K511 S516	H510-M514 PolarHBondContact O-N 2.88Å; K511-M514 PolarHBondContact O-N 3.23Å; M514-S516 PolarHBondContact O-N 3.25Å; M514-S516 VanDerWaalsContact O-N 3.09Å
515	H	59	Low	62.6	Low	156 Å²	156	122 Å²	122	72%	0.722	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-12.8	174.4	-72.9	30.8	0	0	0	114.2	K511 Q517	K511-H515 WeakPolarHBondContact O-CB 3.33Å; K511-H515 PolarHBondContact O-N 3.42Å; K511-H515 PolarHBondContact O-ND1 3.37Å; H515-Q517 PolarHBondContact O-N 3.3Å
516	S	53.8	Low	60.2	Low	72 Å²	72	130.2 Å²	130.2	50%	0.503	62%	0.62	S	S	.	*	S	Bend	trans	-89.6	95.6	167.7	69.6	0	0	0	0	109	R512 R513 M514	R512-S516 PolarHBondContact O-OG 2.83Å; R513-S516 PolarHBondContact O-N 3.42Å; R513-S516 VanDerWaalsContact O-N 3.11Å; R513-S516 VanDerWaalsContact O-O 3.08Å; R513-S516 PolarHBondContact O-OG 3.4Å; M514-S516 PolarHBondContact O-N 3.25Å; M514-S516 VanDerWaalsContact O-N 3.09Å
517	Q	47.4	Very low	58	Low	173 Å²	173	137.6 Å²	137.6	81%	0.808	64%	0.644	S	S	*	*			trans	-34.2	129.6	175.2	-88.1	-168.5	-15.1	0	0	110.7	H515 R519	H515-Q517 PolarHBondContact O-N 3.3Å; Q517-R519 VanDerWaalsContact C-N 3.33Å; Q517-R519 PolarHBondContact O-N 2.86Å
518	P	50.6	Low	55.5	Low	126 Å²	126	138.5 Å²	138.5	82%	0.818	65%	0.65	S	S	*	*			trans	-61.6	97.3	-176.5	24.4	-33.6	0	0	0	108.9	S520	P518-S520 VanDerWaalsContact C-N 3.29Å; P518-S520 PolarHBondContact O-N 3.11Å
519	R	50.5	Low	53.4	Low	234 Å²	234	143.8 Å²	143.8	88%	0.883	69%	0.685	S	S	*	*			trans	-60	97.8	175.9	-87.2	-167.8	172.4	-142.6	-1.6	107.3	Q517 R521	Q517-R519 VanDerWaalsContact C-N 3.33Å; Q517-R519 PolarHBondContact O-N 2.86Å; R519-R521 PolarHBondContact O-N 3.06Å
520	S	48.5	Very low	51.4	Low	112 Å²	112	144.2 Å²	144.2	78%	0.783	70%	0.7	S	S	*	*			trans	-47.6	119.5	177.1	55.7	0	0	0	0	107.4	P518 G522	P518-S520 VanDerWaalsContact C-N 3.29Å; P518-S520 PolarHBondContact O-N 3.11Å; S520-G522 PolarHBondContact O-N 2.88Å
521	R	51.7	Low	49.6	Very low	253 Å²	253	152.3 Å²	152.3	96%	0.955	73%	0.728	S	S	*	*			trans	-76.6	51.9	178.6	-82.6	-179.7	164.1	151	-4.2	109.7	R519 R523	R519-R521 PolarHBondContact O-N 3.06Å; R521-R523 PolarHBondContact O-N 3.09Å
522	G	41.4	Very low	48.1	Very low	61 Å²	61	154.7 Å²	154.7	63%	0.629	75%	0.746	S	S	*	*			trans	-61.3	82.7	170.6	0	0	0	0	0	109.7	S520 P524	S520-G522 PolarHBondContact O-N 2.88Å; G522-P524 WeakPolarHBondContact O-CD 3.46Å; G522-P524 VanDerWaalsContact O-N 3.13Å
523	R	46.7	Very low	46.5	Very low	202 Å²	202	154.7 Å²	154.7	76%	0.762	76%	0.761	S	S	*	*			trans	-46.1	113.6	170.6	175.7	-176.7	-179.6	-123.3	5.5	109	R521 S525	R521-R523 PolarHBondContact O-N 3.09Å; R523-S525 VanDerWaalsContact C-N 3.32Å; R523-S525 PolarHBondContact O-N 3.25Å
524	P	41.6	Very low	44.8	Very low	133 Å²	133	150 Å²	150	86%	0.864	76%	0.764	S	S	*	*			trans	-67.2	86.9	-177.6	-23.6	36	0	0	0	111.8	G522 R526	G522-P524 WeakPolarHBondContact O-CD 3.46Å; G522-P524 VanDerWaalsContact O-N 3.13Å; P524-R526 PolarHBondContact O-N 2.85Å
525	S	48.4	Very low	44.2	Very low	92 Å²	92	156 Å²	156	64%	0.643	78%	0.78	S	S	*	*			trans	-102	49.6	-169.2	-170.3	0	0	0	0	112.6	R523	R523-S525 VanDerWaalsContact C-N 3.32Å; R523-S525 PolarHBondContact O-N 3.25Å
526	R	42.5	Very low	43	Very low	189 Å²	189	160 Å²	160	71%	0.713	79%	0.789	S	S	*	*			trans	-138.9	77.6	171.2	-163.6	165.4	178.3	-78.7	-9.5	111.7	P524 E528	P524-R526 PolarHBondContact O-N 2.85Å; R526-E528 IonicContact CZ-OE1 3.23Å; R526-E528 VanDerWaalsContact NH1-CD 3.28Å; R526-E528 IonicContact NH1-OE1 2.6Å; R526-E528 PolarHBondContact NH1-OE1 2.7Å; R526-E528 IonicContact NH2-OE1 3.52Å; R526-E528 PolarHBondContact NH2-OE1 3.14Å; R526-E528 PolarHBondContact O-N 3.09Å
527	R	42.5	Very low	41.9	Very low	246 Å²	246	168.3 Å²	168.3	93%	0.928	81%	0.809	S	S	*	*			trans	-68	116.5	154.4	-83.8	-176.4	172.3	168.8	-2.5	107.3
528	E	35.1	Very low	41.7	Very low	127 Å²	127	164.4 Å²	164.4	59%	0.593	80%	0.798	S	S	*	*			trans	-74.2	130.1	168.3	-65.9	-161.7	127.6	0	0	110.4	R526 V530	R526-E528 IonicContact CZ-OE1 3.23Å; R526-E528 VanDerWaalsContact NH1-CD 3.28Å; R526-E528 IonicContact NH1-OE1 2.6Å; R526-E528 PolarHBondContact NH1-OE1 2.7Å; R526-E528 IonicContact NH2-OE1 3.52Å; R526-E528 PolarHBondContact NH2-OE1 3.14Å; R526-E528 PolarHBondContact O-N 3.09Å; E528-V530 PolarHBondContact O-N 3.47Å
529	P	44.2	Very low	41	Very low	120 Å²	120	165.2 Å²	165.2	78%	0.779	79%	0.792	S	S	*	*			trans	-79.8	101.9	162.7	31.2	-28.7	0	0	0	108.6	R531	P529-R531 PolarHBondContact O-N 2.84Å
530	V	42.1	Very low	40.1	Very low	128 Å²	128	161.6 Å²	161.6	78%	0.776	79%	0.79	S	S	*	*			trans	-58.2	127.2	172	178.5	0	0	0	0	109.1	E528 D532	E528-V530 PolarHBondContact O-N 3.47Å; V530-D532 PolarHBondContact O-N 3.37Å; V530-D532 VanDerWaalsContact O-N 3.16Å
531	R	37.6	Very low	39.6	Very low	233 Å²	233	165.3 Å²	165.3	88%	0.879	79%	0.788	S	S	*	*			trans	-80.9	88.5	177.7	-72.3	-179.6	173.5	175.3	-2	110.5	P529	P529-R531 PolarHBondContact O-N 2.84Å
532	D	39.5	Very low	39	Very low	160 Å²	160	159.7 Å²	159.7	86%	0.856	78%	0.777	S	S	*	*			trans	-78.6	130.8	163.6	-110.1	-45.3	0	0	0	110.7	V530	V530-D532 PolarHBondContact O-N 3.37Å; V530-D532 VanDerWaalsContact O-N 3.16Å
533	V	35.8	Very low	38.6	Very low	139 Å²	139	163 Å²	163	84%	0.842	78%	0.778	S	S	*	*			trans	-109.4	109.6	-170.6	178.4	0	0	0	0	111.1
534	G	33.5	Very low	38.3	Very low	66 Å²	66	161.9 Å²	161.9	68%	0.68	78%	0.782	S	S	*	*			trans	124.6	112.2	145.2	0	0	0	0	0	117.8
535	R	36.3	Very low	37.8	Very low	253 Å²	253	162.5 Å²	162.5	96%	0.955	78%	0.778	S	S	*	*				-155.6	145.1	120	-106.9	170.2	-165.5	-92.7	-0.7	110
536	R	34.2	Very low	37.2	Very low	242 Å²	242	162.5 Å²	162.5	91%	0.913	78%	0.778	S	S	*	*			trans	-83.7	152.5	-177.9	-66.3	179.5	177.2	-108.9	4.3	111.9
537	R	30.9	Very low	36.9	Very low	245 Å²	245	164.9 Å²	164.9	93%	0.925	79%	0.787	S	S	*	*			trans	-140.9	126.6	144.2	-167.7	171.4	-175.5	133.7	2.9	108.3
538	P	41.6	Very low	36.7	Very low	91 Å²	91	162.8 Å²	162.8	59%	0.591	78%	0.784	S	S	*	*			trans	-107.8	178.2	-175.8	18.4	3.3	0	0	0	113.9
539	E	35.9	Very low	37	Very low	144 Å²	144	166.4 Å²	166.4	67%	0.673	80%	0.798	S	S	*	*			trans	66.1	147.7	179.7	-48.8	-47.2	133.8	0	0	114.5
540	D	33	Very low	37.1	Very low	157 Å²	157	166 Å²	166	84%	0.84	80%	0.795	S	S	*	*			cis	-127.9	-179.8	30.2	-85.3	-60.3	0	0	0	116.5
541	Y	36.7	Very low	36.7	Very low	191 Å²	191	170.2 Å²	170.2	75%	0.749	80%	0.797	S	S	*	*			trans	-69.6	167.5	-156.9	-103.7	-109.2	0	0	0	121.1
542	D	39.1	Very low	36.7	Very low	135 Å²	135	164.9 Å²	164.9	72%	0.722	79%	0.785	S	S	*	*			trans	-44	163.5	160.8	-77.4	-71.7	0	0	0	116.2
543	I	34.2	Very low	36.2	Very low	129 Å²	129	164.4 Å²	164.4	66%	0.662	78%	0.782	S	S	*	*				168.6	115.9	111.7	-83.1	153.5	0	0	0	110.7
544	H	39.3	Very low	36.1	Very low	180 Å²	180	168.3 Å²	168.3	83%	0.833	78%	0.784	S	S	*	*				175.1	61.8	129.4	-92	-54.3	0	0	0	114.8
545	N	30.9	Very low	37.2	Very low	145 Å²	145	170.3 Å²	170.3	78%	0.775	79%	0.785	S	S	*	*			trans	9.8	112.7	138.5	-168.6	13.4	0	0	0	120.5
546	S	36.7	Very low	37.9	Very low	93 Å²	93	163.2 Å²	163.2	65%	0.65	77%	0.771	S	S	*	*			trans	17.5	142.6	146.6	81.3	0	0	0	0	124.3
547	R	36.7	Very low	37.9	Very low	238 Å²	238	159.4 Å²	159.4	90%	0.898	76%	0.764	S	S	*	*			trans	175.4	132.3	140.6	-94	147.8	-174.9	-161.5	1.5	108
548	K	38	Very low	38	Very low	203 Å²	203	156.3 Å²	156.3	88%	0.883	76%	0.757	S	S	*	*			cis	-136.1	-174	8.6	-59.4	-177.7	-178.1	173.7	0	111.6
549	K	41.2	Very low	37.7	Very low	202 Å²	202	159.2 Å²	159.2	88%	0.878	76%	0.763	S	S	*	*			trans	-96.2	-161.1	-175.4	-55.1	-179.2	178.8	-178	0	112.5
550	P	46.6	Very low	37.6	Very low	111 Å²	111	160 Å²	160	72%	0.721	77%	0.767	S	S	*	*				-130.7	-163	-91.7	43.7	-25.1	0	0	0	114.1
551	R	33.2	Very low	37.7	Very low	217 Å²	217	162.9 Å²	162.9	82%	0.819	77%	0.766	S	S	*	*			trans	11	144.6	144.5	-73.4	-178.4	107.3	106.9	-3.8	118.5
552	I	37.4	Very low	37.7	Very low	122 Å²	122	160.2 Å²	160.2	63%	0.626	77%	0.772	S	S	*	*			cis	-168.5	-169.8	32.4	-136.7	165.4	0	0	0	112.8
553	D	29.9	Very low	37.3	Very low	149 Å²	149	156.5 Å²	156.5	80%	0.797	77%	0.765	S	S	*	*			trans	89.4	154.9	164.1	-66.2	-36.2	0	0	0	123.5
554	Y	32	Very low	37.2	Very low	221 Å²	221	161.8 Å²	161.8	87%	0.867	78%	0.779	S	S	*	*			trans	-166.3	-172.7	-168.4	-128.6	-103.5	0	0	0	106.7
555	P	57.1	Low	37	Very low	109 Å²	109	161 Å²	161	71%	0.708	78%	0.779	S	S	*	*			cis	-78.3	-126.7	-31.6	-20.6	40.4	0	0	0	114.4
556	P	51.8	Low	37.1	Very low	103 Å²	103	161.9 Å²	161.9	67%	0.669	78%	0.777	S	S	*	*			cis	-144.6	-174.8	4.4	45.9	-24.2	0	0	0	120
557	E	34.5	Very low	37	Very low	162 Å²	162	162 Å²	162	76%	0.757	77%	0.77	S	S	*	*			trans	35.4	111.6	161.8	-82.2	70.2	-82.5	0	0	124.4
558	F	31.5	Very low	37.4	Very low	180 Å²	180	156.3 Å²	156.3	79%	0.789	76%	0.764	S	S	*	*				13.3	132.6	129.8	-87.8	-80.6	0	0	0	120.7
559	H	36.9	Very low	37.3	Very low	153 Å²	153	155.8 Å²	155.8	71%	0.708	76%	0.756	S	S	*	*				-173.9	174.6	74.6	-88.2	-60.2	0	0	0	110.4
560	Q	32.4	Very low	36.8	Very low	161 Å²	161	156.8 Å²	156.8	75%	0.752	76%	0.756	S	S	*	*			cis	-156.7	-158.2	1.7	-130.8	164.4	70.7	0	0	111.5
561	R	36.1	Very low	35.9	Very low	217 Å²	217	159.7 Å²	159.7	82%	0.819	76%	0.76	S	S	*	*			trans	-133.3	162.3	163.7	-64.6	-177.6	163.7	-162.3	-2.3	109.6
562	P	36.9	Very low	36	Very low	134 Å²	134	157.4 Å²	157.4	87%	0.87	76%	0.759	S	S	*	*				-139.8	166.4	78.7	34.5	-16.9	0	0	0	113.9
563	G	30.9	Very low	35.6	Very low	57 Å²	57	156.8 Å²	156.8	59%	0.588	76%	0.76	S	S	*	*			cis	152	126.7	-7.4	0	0	0	0	0	112.8
564	Y	31.6	Very low	35.5	Very low	241 Å²	241	155.7 Å²	155.7	95%	0.945	75%	0.754	S	S	*	*			trans	-149.6	158.2	156.6	-128.8	-90.9	0	0	0	109.7
565	L	33.9	Very low	35.8	Very low	162 Å²	162	150.7 Å²	150.7	85%	0.848	75%	0.752	S	S	*	*			trans	-106	150.4	-160.6	-159.4	68.1	0	0	0	113
566	K	33.1	Very low	34.6	Very low	165 Å²	165	154.8 Å²	154.8	72%	0.717	76%	0.759	S	S	*	*			trans	-80.2	137.4	166.9	-128	-164.5	-178.1	-165.1	0	108.8	E572	K566-E572 IonicContact NZ-OE2 3.18Å
567	D	34.5	Very low	33.6	Very low	94 Å²	94	156.2 Å²	156.2	50%	0.503	77%	0.766	S	S	.	*			trans	-78.4	125.5	165.4	-176.7	-15	0	0	0	108.6	R569	D567-R569 PolarHBondContact O-N 2.88Å; D567-R569 VanDerWaalsContact O-N 3.09Å; D567-R569 WeakPolarHBondContact OD1-CG 3.42Å; D567-R569 IonicContact OD1-CZ 3.21Å; D567-R569 PolarHBondContact OD1-N 2.81Å; D567-R569 IonicContact OD1-NE 3.33Å; D567-R569 PolarHBondContact OD1-NE 3.41Å; D567-R569 VanDerWaalsContact OD1-NE 3.07Å; D567-R569 IonicContact OD2-CZ 2.67Å; D567-R569 IonicContact OD2-NE 2.68Å; D567-R569 PolarHBondContact OD2-NE 2.84Å; D567-R569 VanDerWaalsContact OD2-NE 3.14Å; D567-R569 IonicContact OD2-NH2 3.86Å; D567-R569 PolarHBondContact OD2-NH2 3.34Å
568	P	45.5	Very low	33.6	Very low	119 Å²	119	155.7 Å²	155.7	77%	0.773	77%	0.768	S	S	*	*	S	Bend	trans	-71.3	5.7	-173.1	-21.7	34.8	0	0	0	117.4	Y570	P568-Y570 PolarHBondContact O-N 3Å
569	R	36	Very low	33.7	Very low	192 Å²	192	155.3 Å²	155.3	73%	0.725	77%	0.773	S	S	*	*			trans	-90.5	20.4	-164.7	-65.1	-179.8	-56.7	115.8	4.8	117	D567	D567-R569 PolarHBondContact O-N 2.88Å; D567-R569 VanDerWaalsContact O-N 3.09Å; D567-R569 WeakPolarHBondContact OD1-CG 3.42Å; D567-R569 IonicContact OD1-CZ 3.21Å; D567-R569 PolarHBondContact OD1-N 2.81Å; D567-R569 IonicContact OD1-NE 3.33Å; D567-R569 PolarHBondContact OD1-NE 3.41Å; D567-R569 VanDerWaalsContact OD1-NE 3.07Å; D567-R569 IonicContact OD2-CZ 2.67Å; D567-R569 IonicContact OD2-NE 2.68Å; D567-R569 PolarHBondContact OD2-NE 2.84Å; D567-R569 VanDerWaalsContact OD2-NE 3.14Å; D567-R569 IonicContact OD2-NH2 3.86Å; D567-R569 PolarHBondContact OD2-NH2 3.34Å
570	Y	30.8	Very low	33.4	Very low	223 Å²	223	155.3 Å²	155.3	88%	0.875	78%	0.777	S	S	*	*			trans	-138.4	122	162.2	-97.5	-86.3	0	0	0	109.6	P568	P568-Y570 PolarHBondContact O-N 3Å
571	Q	28	Very low	33.7	Very low	173 Å²	173	154 Å²	154	81%	0.808	78%	0.782	S	S	*	*			trans	-100.3	126	176.3	-174.9	168.4	-9.8	0	0	108.3
572	E	34.1	Very low	33.6	Very low	169 Å²	169	149.8 Å²	149.8	79%	0.79	78%	0.776	S	S	*	*			trans	-82.7	126.1	171.8	-70.5	165.5	100.8	0	0	108.5	K566	K566-E572 IonicContact NZ-OE2 3.18Å
573	V	29.9	Very low	33.5	Very low	108 Å²	108	150.4 Å²	150.4	66%	0.655	76%	0.761	S	S	*	*			trans	-146	120.1	162.3	-100	0	0	0	0	109.7
574	D	28.2	Very low	33.9	Very low	126 Å²	126	158.8 Å²	158.8	67%	0.674	78%	0.775	S	S	*	*			trans	55.1	81.7	143.6	-52.4	-34.6	0	0	0	121.3	F576	D574-F576 PolarHBondContact O-N 2.97Å
575	S	38	Very low	34.1	Very low	116 Å²	116	155.8 Å²	155.8	81%	0.811	77%	0.767	S	S	*	*				45	22	95.4	-45.7	0	0	0	0	121.4
576	F	31.2	Very low	34.5	Very low	196 Å²	196	153.7 Å²	153.7	86%	0.86	77%	0.766	S	S	*	*			trans	-116.7	41.9	-177.5	-142.8	-91.3	0	0	0	115.5	D574	D574-F576 PolarHBondContact O-N 2.97Å
577	T	31.7	Very low	35	Very low	132 Å²	132	149.1 Å²	149.1	81%	0.81	77%	0.766	S	S	*	*			trans	-138.2	56.5	178.8	52.5	0	0	0	0	113.3
578	N	35.2	Very low	35.2	Very low	151 Å²	151	150 Å²	150	81%	0.807	77%	0.774	S	S	*	*			trans	-130.8	17.1	178.2	-89.8	-73.6	0	0	0	115
579	L	31.6	Very low	35.1	Very low	173 Å²	173	153.4 Å²	153.4	91%	0.906	77%	0.772	S	S	*	*			trans	-120	66.6	173.8	-103.9	78.4	0	0	0	111.1
580	I	31.8	Very low	35.3	Very low	153 Å²	153	155.8 Å²	155.8	79%	0.785	78%	0.781	S	S	*	*			trans	-132.3	106.4	159.2	-60.3	179.6	0	0	0	107	N582	I580-N582 VanDerWaalsContact C-N 3.33Å; I580-N582 HydrophobicContact CG2-CB 4.33Å; I580-N582 PolarHBondContact O-N 2.82Å
581	P	37.9	Very low	36.1	Very low	132 Å²	132	151.1 Å²	151.1	86%	0.857	77%	0.771	S	S	*	*			trans	-91.2	31.2	-168.7	36.7	-36.7	0	0	0	114.3
582	N	34.4	Very low	37	Very low	130 Å²	130	148.1 Å²	148.1	70%	0.695	76%	0.764	S	S	*	*			trans	-73.9	153.3	-168.2	-144	-40.7	0	0	0	114.4	I580	I580-N582 VanDerWaalsContact C-N 3.33Å; I580-N582 HydrophobicContact CG2-CB 4.33Å; I580-N582 PolarHBondContact O-N 2.82Å
583	R	36	Very low	37.3	Very low	146 Å²	146	147.1 Å²	147.1	55%	0.551	76%	0.757	S	S	*	*			trans	-62.6	139	-146.6	-65.9	163.1	174	-162.8	-8.3	115.2	E242 F585	E242-R583 IonicContact OE1-CZ 2.88Å; E242-R583 VanDerWaalsContact OE1-CZ 3.23Å; E242-R583 IonicContact OE1-NH1 2.61Å; E242-R583 PolarHBondContact OE1-NH1 3.1Å; E242-R583 IonicContact OE1-NH2 2.73Å; E242-R583 IonicContact OE2-CZ 3.19Å; E242-R583 IonicContact OE2-NH1 3.09Å; E242-R583 PolarHBondContact OE2-NH1 3.31Å; E242-R583 IonicContact OE2-NH2 3.73Å; E242-R583 PolarHBondContact OE2-NH2 3.47Å; R583-F585 HydrophobicContact CB-CD2 4.48Å
584	R	38	Very low	38.3	Very low	234 Å²	234	148.8 Å²	148.8	88%	0.883	76%	0.762	S	S	*	*			trans	-118.8	94.6	161.4	-76.9	-166.5	-178.8	-171.5	3.2	111.3	S586	R584-S586 VanDerWaalsContact C-N 3.29Å; R584-S586 PolarHBondContact O-N 3.3Å
585	F	36.3	Very low	39.3	Very low	178 Å²	178	150.4 Å²	150.4	78%	0.781	77%	0.771	S	S	*	*			trans	-67.6	82.3	166.4	-83.4	-84.2	0	0	0	111.5	R583	R583-F585 HydrophobicContact CB-CD2 4.48Å
586	S	42.1	Very low	39.9	Very low	117 Å²	117	146.8 Å²	146.8	82%	0.818	75%	0.751	S	S	*	*			trans	-107.4	67	171.3	68.5	0	0	0	0	111.2	R584	R584-S586 VanDerWaalsContact C-N 3.29Å; R584-S586 PolarHBondContact O-N 3.3Å
587	G	43.3	Very low	41.3	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	73%	0.727	S	S	*	*			trans	-148.1	-39.9	-174.7	0	0	0	0	0	117
588	V	40	Very low	42	Very low	111 Å²	111	141 Å²	141	67%	0.673	72%	0.718	S	S	*	*			trans	-72.6	140.5	-168.4	-170.4	0	0	0	0	112.4
589	R	42.3	Very low	42.9	Very low	191 Å²	191	139.1 Å²	139.1	72%	0.721	71%	0.708	S	S	*	*			trans	-84.6	156.6	176.4	-75.7	-176.1	170.6	-178.4	-0.3	111.8	D591	R589-D591 HydrophobicContact CB-CB 4.48Å; R589-D591 PolarHBondContact O-N 2.9Å
590	R	41.1	Very low	43.8	Very low	243 Å²	243	134.3 Å²	134.3	92%	0.917	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	6.9	179.9	-88.7	-170.4	166.7	88.5	2.7	114.7
591	D	45.8	Very low	45.1	Very low	124 Å²	124	134.1 Å²	134.1	66%	0.663	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	5.6	-154.6	-42.4	-19.7	0	0	0	112.4	R589	R589-D591 HydrophobicContact CB-CB 4.48Å; R589-D591 PolarHBondContact O-N 2.9Å
592	V	47.1	Very low	46.4	Very low	110 Å²	110	130.4 Å²	130.4	67%	0.667	65%	0.648	S	S	*	*			trans	-110.9	-15.5	-164.6	-173.9	0	0	0	0	113.7	L594	V592-L594 PolarHBondContact O-N 2.83Å
593	F	40.7	Very low	47.8	Very low	149 Å²	149	132.2 Å²	132.2	65%	0.654	65%	0.645	S	S	*	*			trans	-91.2	103.1	-177.9	-67.3	-75.5	0	0	0	112.4	N595 G596	F593-N595 PolarHBondContact O-N 3.35Å; F593-G596 PolarHBondContact O-N 2.72Å
594	L	51.7	Low	48.8	Very low	142 Å²	142	131.7 Å²	131.7	74%	0.743	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-25.4	-178.4	-150.6	72.3	0	0	0	113.8	V592	V592-L594 PolarHBondContact O-N 2.83Å
595	N	47.9	Very low	49.4	Very low	161 Å²	161	127.1 Å²	127.1	86%	0.861	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	17.4	176	-75.4	8.7	0	0	0	113.9	F593	F593-N595 PolarHBondContact O-N 3.35Å
596	G	52.1	Low	50.3	Low	39 Å²	39	125.5 Å²	125.5	40%	0.402	63%	0.631	S	S	.	*			trans	73.3	-170.7	177.1	0	0	0	0	0	115	F593	F593-G596 PolarHBondContact O-N 2.72Å
597	S	60	Low	51.1	Low	51 Å²	51	126.5 Å²	126.5	36%	0.357	63%	0.627	S	S	.	*			trans	-84.1	152.2	176.6	-173.3	0	0	0	0	111.2	N599 D600 Y601	S597-N599 PolarHBondContact O-N 3.37Å; S597-N599 PolarHBondContact OG-N 2.87Å; S597-N599 PolarHBondContact OG-ND2 3.09Å; S597-N599 VanDerWaalsContact OG-ND2 3.17Å; S597-D600 PolarHBondContact O-N 2.84Å; S597-Y601 PolarHBondContact O-N 3.49Å
598	Y	46.9	Very low	51.4	Low	157 Å²	157	130.3 Å²	130.3	62%	0.616	63%	0.628	S	S	*	*	H	α-helix	trans	-45.7	-34.5	163.8	-177.7	-96.9	0	0	0	112.8	D600 V602	Y598-D600 VanDerWaalsContact C-N 3.3Å; Y598-D600 PolarHBondContact O-N 2.94Å; Y598-V602 HydrophobicContact CD1-CG2 4.27Å; Y598-V602 HydrophobicContact CE1-CG2 3.99Å; Y598-V602 WeakPolarHBondContact O-CG2 3.46Å; Y598-V602 PolarHBondContact O-N 2.68Å; Y598-V602 VanDerWaalsContact O-N 3.12Å
599	N	54.6	Low	52.2	Low	110 Å²	110	127.8 Å²	127.8	59%	0.588	62%	0.624	S	S	*	*	H	α-helix	trans	-65.8	-27.2	176.8	-68.2	-88.2	0	0	0	114.2	S597 R603	S597-N599 PolarHBondContact O-N 3.37Å; S597-N599 PolarHBondContact OG-N 2.87Å; S597-N599 PolarHBondContact OG-ND2 3.09Å; S597-N599 VanDerWaalsContact OG-ND2 3.17Å; N599-R603 WeakPolarHBondContact O-CG 3.46Å; N599-R603 PolarHBondContact O-N 3.14Å
600	D	49.9	Very low	52.8	Low	73 Å²	73	124.8 Å²	124.8	39%	0.39	63%	0.629	S	S	.	*	H	α-helix	trans	-87.9	-37.3	179.7	-60.1	-55.7	0	0	0	110.7	S597 Y598 V602 R603 E604	S597-D600 PolarHBondContact O-N 2.84Å; Y598-D600 VanDerWaalsContact C-N 3.3Å; Y598-D600 PolarHBondContact O-N 2.94Å; D600-V602 VanDerWaalsContact C-N 3.32Å; D600-V602 PolarHBondContact O-N 3.24Å; D600-R603 WeakPolarHBondContact O-CB 3.44Å; D600-R603 PolarHBondContact O-N 2.77Å; D600-R603 IonicContact OD1-NH1 3.8Å; D600-R603 PolarHBondContact OD1-NH1 2.75Å; D600-R603 VanDerWaalsContact OD1-NH1 3.09Å; D600-E604 PolarHBondContact O-N 2.95Å
601	Y	59.4	Low	53.1	Low	148 Å²	148	118.3 Å²	118.3	58%	0.58	62%	0.619	S	S	*	*	H	α-helix	trans	-55.1	-44.9	167.9	176.7	-106.3	0	0	0	112.3	S597 R603 E604 F605	S597-Y601 PolarHBondContact O-N 3.49Å; Y601-R603 VanDerWaalsContact C-N 3.26Å; Y601-R603 PolarHBondContact O-N 3.17Å; Y601-E604 PolarHBondContact O-N 2.76Å; Y601-F605 WeakPolarHBondContact O-CB 3.39Å; Y601-F605 PolarHBondContact O-N 2.91Å
602	V	64.3	Low	53.2	Low	55 Å²	55	117.5 Å²	117.5	33%	0.333	62%	0.62	S	S	.	*	H	α-helix	trans	-66.2	-26.2	176.8	176.5	0	0	0	0	112.4	Y598 D600 H606	Y598-V602 HydrophobicContact CD1-CG2 4.27Å; Y598-V602 HydrophobicContact CE1-CG2 3.99Å; Y598-V602 WeakPolarHBondContact O-CG2 3.46Å; Y598-V602 PolarHBondContact O-N 2.68Å; Y598-V602 VanDerWaalsContact O-N 3.12Å; D600-V602 VanDerWaalsContact C-N 3.32Å; D600-V602 PolarHBondContact O-N 3.24Å; V602-H606 PolarHBondContact O-CD2 3.05Å
603	R	64.7	Low	52.9	Low	167 Å²	167	118 Å²	118	63%	0.63	63%	0.625	S	S	*	*	H	α-helix	trans	-74.3	-44.3	172.6	-76.1	168.2	168	167.7	-5.2	112.3	N599 D600 Y601 H606 N607	N599-R603 WeakPolarHBondContact O-CG 3.46Å; N599-R603 PolarHBondContact O-N 3.14Å; D600-R603 WeakPolarHBondContact O-CB 3.44Å; D600-R603 PolarHBondContact O-N 2.77Å; D600-R603 IonicContact OD1-NH1 3.8Å; D600-R603 PolarHBondContact OD1-NH1 2.75Å; D600-R603 VanDerWaalsContact OD1-NH1 3.09Å; Y601-R603 VanDerWaalsContact C-N 3.26Å; Y601-R603 PolarHBondContact O-N 3.17Å; R603-H606 PolarHBondContact O-N 2.82Å; R603-N607 PolarHBondContact O-N 3.32Å
604	E	56.2	Low	53	Low	136 Å²	136	122.9 Å²	122.9	64%	0.636	64%	0.639	S	S	*	*	H	α-helix	trans	-65.2	-42.9	-179.7	-169.1	123.9	-134.2	0	0	111.2	D600 Y601 H606 N607 M608	D600-E604 PolarHBondContact O-N 2.95Å; Y601-E604 PolarHBondContact O-N 2.76Å; E604-H606 PolarHBondContact O-N 3.17Å; E604-N607 PolarHBondContact O-N 3.09Å; E604-M608 PolarHBondContact O-N 3.03Å
605	F	50.8	Low	52.6	Low	137 Å²	137	125.1 Å²	125.1	60%	0.601	65%	0.646	S	S	*	*	H	α-helix	trans	-57.6	-32.7	175	-167.8	-89.9	0	0	0	113.2	Y601	Y601-F605 WeakPolarHBondContact O-CB 3.39Å; Y601-F605 PolarHBondContact O-N 2.91Å
606	H	56.4	Low	52	Low	145 Å²	145	120.6 Å²	120.6	67%	0.671	64%	0.637	S	S	*	*	H	α-helix	trans	-82.2	-11.4	177.3	-85.3	-110.1	0	0	0	114.3	V602 R603 E604	V602-H606 PolarHBondContact O-CD2 3.05Å; R603-H606 PolarHBondContact O-N 2.82Å; E604-H606 PolarHBondContact O-N 3.17Å
607	N	57.8	Low	51.2	Low	137 Å²	137	127.2 Å²	127.2	73%	0.733	66%	0.66	S	S	*	*	H	α-helix	trans	-94.8	-15.2	177.2	-72.7	-19.2	0	0	0	113.2	R603 E604 G609	R603-N607 PolarHBondContact O-N 3.32Å; E604-N607 PolarHBondContact O-N 3.09Å; N607-G609 PolarHBondContact O-N 2.79Å
608	M	50.2	Low	50.4	Low	151 Å²	151	129.8 Å²	129.8	74%	0.744	68%	0.676	S	S	*	*			trans	-70.9	113.1	172.8	-74.1	-66	-166.3	0	0	110.8	E604	E604-M608 PolarHBondContact O-N 3.03Å
609	G	57	Low	50.2	Low	57 Å²	57	128.1 Å²	128.1	59%	0.588	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-65.2	161.7	172.1	0	0	0	0	0	112.6	N607	N607-G609 PolarHBondContact O-N 2.79Å
610	P	53.3	Low	49.4	Very low	129 Å²	129	133.7 Å²	133.7	84%	0.838	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-60.8	140.5	-179.4	26	-34.6	0	0	0	111.5
611	P	48.4	Very low	48.9	Very low	107 Å²	107	136.2 Å²	136.2	70%	0.695	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-67.5	153.9	-176.5	28.3	-35.6	0	0	0	112.1
612	P	47.5	Very low	48.2	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-64.6	148.9	175.4	28.5	-35	0	0	0	111.4	W614	P612-W614 PolarHBondContact O-N 3.27Å
613	P	41.9	Very low	47	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-67.8	129	177.9	28.2	-34.1	0	0	0	110.9	Q615	P613-Q615 PolarHBondContact O-N 3.13Å
614	W	41.7	Very low	45.7	Very low	252 Å²	252	140.7 Å²	140.7	96%	0.955	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-66.8	117.5	-179.2	-70.1	70	0	0	0	111	P612	P612-W614 PolarHBondContact O-N 3.27Å
615	Q	43.6	Very low	44.9	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	78%	0.779	S	S	*	*			trans	-104	112.8	173.6	-74.7	-170.8	-25.1	0	0	111.5	P613	P613-Q615 PolarHBondContact O-N 3.13Å
616	G	36.3	Very low	44.4	Very low	66 Å²	66	141.2 Å²	141.2	68%	0.68	79%	0.785	S	S	*	*			trans	70.8	98.3	148.2	0	0	0	0	0	118.4
617	M	34.6	Very low	43.8	Very low	179 Å²	179	140.6 Å²	140.6	88%	0.882	79%	0.794	S	S	*	*			trans	-122.4	147.8	140.9	-87.1	-68.8	132.5	0	0	108.9
618	P	41.9	Very low	42.6	Very low	105 Å²	105	140.8 Å²	140.8	68%	0.682	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78	147.6	-169.2	31.4	-35	0	0	0	112.4
619	P	43.1	Very low	41.9	Very low	121 Å²	121	140.9 Å²	140.9	79%	0.786	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-73	140.3	175.6	30.5	-34.3	0	0	0	111.6
620	Y	38	Very low	41.2	Very low	228 Å²	228	144.1 Å²	144.1	89%	0.894	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.7	136.8	165.5	-99.9	-99.2	0	0	0	110.2
621	P	39.6	Very low	40.3	Very low	126 Å²	126	147.2 Å²	147.2	82%	0.818	80%	0.795	S	S	*	*	S	Bend	trans	-76	142.6	174	-9.6	26	0	0	0	111.4
622	G	45.9	Very low	39.7	Very low	75 Å²	75	152.1 Å²	152.1	77%	0.773	80%	0.802	S	S	*	*			trans	147.9	-6.7	152.9	0	0	0	0	0	120.8
623	M	38.5	Very low	39.3	Very low	195 Å²	195	153.2 Å²	153.2	96%	0.961	80%	0.797	S	S	*	*			trans	-136.2	138.7	177.9	-66.7	-169	175.1	0	0	113
624	E	36.9	Very low	39	Very low	193 Å²	193	155.5 Å²	155.5	90%	0.902	80%	0.797	S	S	*	*			trans	-86.9	151.4	-174.7	-62.7	-178.4	112.9	0	0	113
625	Q	40.3	Very low	38.8	Very low	172 Å²	172	151.3 Å²	151.3	80%	0.804	79%	0.788	S	S	*	*			trans	-110.6	130.3	165.2	-74.7	-171.9	-7.6	0	0	110.9
626	P	39.8	Very low	38.4	Very low	113 Å²	113	147 Å²	147	73%	0.734	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-70.4	160.1	156.9	-16.9	32.6	0	0	0	111.8
627	P	42.9	Very low	38.7	Very low	132 Å²	132	149.5 Å²	149.5	86%	0.857	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-88.5	161	-152.7	33.7	-37.9	0	0	0	116.9
628	H	32.5	Very low	39.1	Very low	140 Å²	140	146.5 Å²	146.5	65%	0.648	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-96.8	148.9	-178.9	-105.3	-106.1	0	0	0	114
629	H	37	Very low	39.1	Very low	154 Å²	154	147.6 Å²	147.6	71%	0.713	79%	0.79	S	S	*	*			trans	74.2	148.9	154.1	-64.8	-37.5	0	0	0	117.5
630	P	41.5	Very low	39	Very low	124 Å²	124	151.2 Å²	151.2	81%	0.805	80%	0.796	S	S	*	*			cis	-133.4	161.9	49.9	40.3	-23.4	0	0	0	119.8
631	Y	34.7	Very low	38.9	Very low	195 Å²	195	145 Å²	145	77%	0.765	79%	0.793	S	S	*	*			trans	-22.9	147.6	163.3	-70.7	-102.6	0	0	0	119.6
632	Y	35	Very low	38.8	Very low	210 Å²	210	148 Å²	148	82%	0.824	80%	0.795	S	S	*	*				-147.4	161.3	119	-129.2	-91	0	0	0	112	H634	Y632-H634 AromaticContact CD1-NE2 3.54Å
633	Q	39.1	Very low	38.5	Very low	130 Å²	130	150 Å²	150	61%	0.607	80%	0.795	S	S	*	*			trans	-133.4	130.3	-169.8	171.2	-178	-24.5	0	0	111.3	H635	Q633-H635 PolarHBondContact NE2-NE2 2.9Å
634	H	37	Very low	39.1	Very low	167 Å²	167	146.4 Å²	146.4	77%	0.773	79%	0.786	S	S	*	*			trans	-138.4	143	175.2	-72.2	-74.6	0	0	0	113.1	Y632	Y632-H634 AromaticContact CD1-NE2 3.54Å
635	H	36.7	Very low	39	Very low	163 Å²	163	147.2 Å²	147.2	76%	0.755	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-103.4	153.7	175.3	-65.3	-92.5	0	0	0	110.4	Q633	Q633-H635 PolarHBondContact NE2-NE2 2.9Å
636	A	35.7	Very low	38.7	Very low	98 Å²	98	144.1 Å²	144.1	81%	0.81	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-86.2	141.3	179.5	0	0	0	0	0	113.2
637	P	42.1	Very low	38.3	Very low	119 Å²	119	142.3 Å²	142.3	77%	0.773	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-85.4	165.5	172.6	35.1	-34.7	0	0	0	113.2
638	P	43.6	Very low	37.8	Very low	116 Å²	116	145.5 Å²	145.5	75%	0.753	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-86	162.3	-173.6	35.1	-37.1	0	0	0	114.7
639	P	42	Very low	37.9	Very low	128 Å²	128	146.6 Å²	146.6	83%	0.831	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77.9	156.4	-179.2	32.5	-36.6	0	0	0	114
640	Q	39.3	Very low	38.2	Very low	197 Å²	197	145.1 Å²	145.1	92%	0.921	79%	0.794	S	S	*	*			trans	-130.9	159.7	167.3	-70.7	-167.4	-11.8	0	0	110.9
641	A	35.9	Very low	38.2	Very low	99 Å²	99	144.1 Å²	144.1	82%	0.818	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-97	159.5	-165.6	0	0	0	0	0	114.7
642	H	38.9	Very low	38.6	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.866	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-81.8	146	176	-58.2	-91.3	0	0	0	113.2
643	P	40.1	Very low	38.6	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-93.1	162.7	155.7	36.5	-31.3	0	0	0	112.1
644	P	50.2	Low	38.2	Very low	119 Å²	119	142.1 Å²	142.1	77%	0.773	80%	0.8	S	S	*	*			trans	-110.8	179.5	-168.6	41.5	-35.4	0	0	0	116
645	Y	34	Very low	38.2	Very low	210 Å²	210	139 Å²	139	82%	0.824	80%	0.804	S	S	*	*			trans	120.5	117.5	136.5	-136	-110.3	0	0	0	119.4
646	S	33.8	Very low	38.5	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	81%	0.811	S	S	*	*			trans	55.5	143.5	146.5	70.7	0	0	0	0	123.5
647	G	31.5	Very low	39	Very low	76 Å²	76	149.2 Å²	149.2	78%	0.784	82%	0.816	S	S	*	*			trans	159.9	110.3	152.3	0	0	0	0	0	116.7
648	H	34	Very low	39	Very low	199 Å²	199	155.3 Å²	155.3	92%	0.921	82%	0.824	S	S	*	*			trans	-58.1	164.5	-174.6	-73	-98	0	0	0	119.3
649	H	34.6	Very low	39.4	Very low	163 Å²	163	155.2 Å²	155.2	76%	0.755	82%	0.817	S	S	*	*			trans	-44.2	167.4	161.7	-101.9	-42.3	0	0	0	116.2
650	P	42.2	Very low	39.8	Very low	123 Å²	123	157.9 Å²	157.9	80%	0.799	82%	0.816	S	S	*	*			cis	-134.2	-179.5	35.9	40	-21.4	0	0	0	117.8
651	V	41.8	Very low	40.4	Very low	103 Å²	103	159 Å²	159	62%	0.624	81%	0.812	S	S	*	*			trans	-99.2	165.3	178.9	-132.8	0	0	0	0	111.6
652	P	42.4	Very low	41.1	Very low	122 Å²	122	158.1 Å²	158.1	79%	0.792	80%	0.795	S	S	*	*				-128.2	166.4	113.4	3.2	18.2	0	0	0	114.5
653	H	35.9	Very low	41.6	Very low	183 Å²	183	155.8 Å²	155.8	85%	0.847	79%	0.785	S	S	*	*			trans	-67.1	137.4	177.7	-83.5	-140.3	0	0	0	113.3
654	E	30.4	Very low	42.6	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	77%	0.769	S	S	*	*				-168.3	177.5	96.9	-100.1	-168.6	176.2	0	0	111
655	A	36.1	Very low	43.3	Very low	103 Å²	103	156.9 Å²	156.9	85%	0.851	77%	0.766	S	S	*	*			trans	75.3	43.9	177.3	0	0	0	0	0	118.9
656	R	44	Very low	44.9	Very low	241 Å²	241	151 Å²	151	91%	0.909	75%	0.749	S	S	*	*			trans	-102	91.4	153.5	-80.6	-172.3	175.2	-175.5	-0.2	110.8
657	Y	45.5	Very low	46.5	Very low	233 Å²	233	151.4 Å²	151.4	91%	0.914	74%	0.74	S	S	*	*			trans	-166.4	43.9	156.7	-104.8	-56	0	0	0	115
658	R	43.6	Very low	48.5	Very low	248 Å²	248	155.9 Å²	155.9	94%	0.936	73%	0.733	S	S	*	*	S	Bend	trans	-165.4	72.5	163.6	-115.3	-176.8	-162.8	-147.6	7.3	113.5
659	D	51.4	Low	50.1	Low	113 Å²	113	149.5 Å²	149.5	60%	0.604	71%	0.708	S	S	*	*				-165.3	130.6	115.5	-137.8	-46.8	0	0	0	111.6	R661 V662	D659-R661 PolarHBondContact OD1-N 3.15Å; D659-V662 PolarHBondContact OD1-N 3.19Å; D659-V662 WeakPolarHBondContact OD2-CG2 3.19Å
660	K	50.5	Low	51.8	Low	185 Å²	185	145.6 Å²	145.6	80%	0.804	69%	0.693	S	S	*	*	S	Bend	trans	-141.7	7.6	170.7	-81.8	-161.7	175.9	-170.6	0	111.3
661	R	51.8	Low	53.1	Low	221 Å²	221	144 Å²	144	83%	0.834	68%	0.677	S	S	*	*	S	Bend	trans	-114.6	-17.1	-175.2	-71.7	-167.4	-66.8	-136.8	0.8	114.1	D659	D659-R661 PolarHBondContact OD1-N 3.15Å
662	V	49.6	Very low	54.6	Low	79 Å²	79	145.8 Å²	145.8	48%	0.479	68%	0.677	S	S	.	*	S	Bend	trans	-74.9	-51.5	170.6	179.4	0	0	0	0	110.8	D659 D664 Y665 D666	D659-V662 PolarHBondContact OD1-N 3.19Å; D659-V662 WeakPolarHBondContact OD2-CG2 3.19Å; V662-D664 VanDerWaalsContact C-N 3.29Å; V662-D664 PolarHBondContact O-N 2.89Å; V662-Y665 WeakPolarHBondContact O-CB 3.25Å; V662-Y665 PolarHBondContact O-N 3.46Å; V662-D666 PolarHBondContact O-N 2.81Å; V662-D666 VanDerWaalsContact O-N 3.13Å
663	H	50.9	Low	56.3	Low	139 Å²	139	143.4 Å²	143.4	64%	0.644	66%	0.657	S	S	*	*	H	α-helix	trans	-57.8	-35.7	-179	-90.2	-44	0	0	0	114.5	Y665 D666 M667	H663-Y665 PolarHBondContact O-N 2.86Å; H663-D666 PolarHBondContact O-N 2.74Å; H663-M667 VanDerWaalsContact O-CB 3.32Å; H663-M667 WeakPolarHBondContact O-CB 3.32Å; H663-M667 VanDerWaalsContact O-CG 3.25Å; H663-M667 WeakPolarHBondContact O-CG 3.24Å; H663-M667 PolarHBondContact O-N 2.82Å
664	D	60.9	Low	57.8	Low	84 Å²	84	140.5 Å²	140.5	45%	0.449	64%	0.639	S	S	.	*	H	α-helix	trans	-61.8	-30	175.8	-105.5	45.8	0	0	0	113.1	V662 R668	V662-D664 VanDerWaalsContact C-N 3.29Å; V662-D664 PolarHBondContact O-N 2.89Å; D664-R668 WeakPolarHBondContact O-CD 3.33Å; D664-R668 WeakPolarHBondContact O-CG 3.37Å; D664-R668 PolarHBondContact O-NE 2.86Å; D664-R668 VanDerWaalsContact O-NE 3.09Å; D664-R668 IonicContact OD2-CZ 3.17Å; D664-R668 IonicContact OD2-NH2 2.84Å; D664-R668 PolarHBondContact OD2-NH2 3.3Å
665	Y	64.7	Low	59.3	Low	177 Å²	177	142 Å²	142	69%	0.694	64%	0.637	S	S	*	*	H	α-helix	trans	-82.3	-45.9	178.2	-141.3	-88.3	0	0	0	110.6	V662 H663 M667 R668 V669	V662-Y665 WeakPolarHBondContact O-CB 3.25Å; V662-Y665 PolarHBondContact O-N 3.46Å; H663-Y665 PolarHBondContact O-N 2.86Å; Y665-M667 PolarHBondContact O-N 2.92Å; Y665-R668 PolarHBondContact O-N 2.89Å; Y665-V669 HydrophobicContact CD1-CG2 4.11Å; Y665-V669 HydrophobicContact CE1-CG2 4.33Å; Y665-V669 WeakPolarHBondContact O-CG2 3.16Å; Y665-V669 PolarHBondContact O-N 3.45Å
666	D	67.1	Low	60.1	Low	87 Å²	87	140.2 Å²	140.2	47%	0.465	62%	0.615	S	S	.	*	H	α-helix	trans	-58.4	-49.4	176.8	-66.3	-28.3	0	0	0	110.8	V662 H663 R668 V669 D670	V662-D666 PolarHBondContact O-N 2.81Å; V662-D666 VanDerWaalsContact O-N 3.13Å; H663-D666 PolarHBondContact O-N 2.74Å; D666-R668 VanDerWaalsContact C-N 3.3Å; D666-R668 PolarHBondContact O-N 2.9Å; D666-V669 PolarHBondContact O-N 3.33Å; D666-V669 VanDerWaalsContact O-N 3.17Å; D666-D670 WeakPolarHBondContact O-CB 3.39Å; D666-D670 PolarHBondContact O-N 3.02Å
667	M	68.4	Low	60.3	Low	113 Å²	113	134.9 Å²	134.9	56%	0.557	60%	0.6	S	S	*	*	H	α-helix	trans	-54.3	-42.5	177.6	-77.9	-71.5	-68.4	0	0	113	H663 Y665 D670 D671	H663-M667 VanDerWaalsContact O-CB 3.32Å; H663-M667 WeakPolarHBondContact O-CB 3.32Å; H663-M667 VanDerWaalsContact O-CG 3.25Å; H663-M667 WeakPolarHBondContact O-CG 3.24Å; H663-M667 PolarHBondContact O-N 2.82Å; Y665-M667 PolarHBondContact O-N 2.92Å; M667-D670 PolarHBondContact O-N 3.23Å; M667-D671 PolarHBondContact O-N 3.07Å
668	R	72.6	Confident	60.4	Low	170 Å²	170	127.5 Å²	127.5	64%	0.642	59%	0.588	S	S	*	*	H	α-helix	trans	-73.6	-35.3	-179.2	-66.6	171.1	-154.9	-158.7	5.2	112.2	D664 Y665 D666 F672	D664-R668 WeakPolarHBondContact O-CD 3.33Å; D664-R668 WeakPolarHBondContact O-CG 3.37Å; D664-R668 PolarHBondContact O-NE 2.86Å; D664-R668 VanDerWaalsContact O-NE 3.09Å; D664-R668 IonicContact OD2-CZ 3.17Å; D664-R668 IonicContact OD2-NH2 2.84Å; D664-R668 PolarHBondContact OD2-NH2 3.3Å; Y665-R668 PolarHBondContact O-N 2.89Å; D666-R668 VanDerWaalsContact C-N 3.3Å; D666-R668 PolarHBondContact O-N 2.9Å; R668-F672 VanDerWaalsContact O-CB 3.29Å; R668-F672 WeakPolarHBondContact O-CB 3.43Å; R668-F672 PolarHBondContact O-N 3.48Å
669	V	68.4	Low	60.5	Low	65 Å²	65	121.6 Å²	121.6	39%	0.394	58%	0.579	S	S	.	*	H	α-helix	trans	-67	-42	172.7	170	0	0	0	0	110.5	Y665 D666 F672 L673	Y665-V669 HydrophobicContact CD1-CG2 4.11Å; Y665-V669 HydrophobicContact CE1-CG2 4.33Å; Y665-V669 WeakPolarHBondContact O-CG2 3.16Å; Y665-V669 PolarHBondContact O-N 3.45Å; D666-V669 PolarHBondContact O-N 3.33Å; D666-V669 VanDerWaalsContact O-N 3.17Å; V669-F672 PolarHBondContact O-N 2.92Å; V669-L673 HydrophobicContact CG1-CD1 3.96Å; V669-L673 WeakPolarHBondContact O-CB 3.41Å; V669-L673 VanDerWaalsContact O-CG 3.28Å; V669-L673 WeakPolarHBondContact O-CG 3.44Å; V669-L673 PolarHBondContact O-N 3.05Å
670	D	68.7	Low	60	Low	81 Å²	81	122.3 Å²	122.3	43%	0.433	59%	0.587	S	S	.	*	H	α-helix	trans	-66.5	-40.1	179.2	-120	35	0	0	0	112.3	D666 M667 L673 R674	D666-D670 WeakPolarHBondContact O-CB 3.39Å; D666-D670 PolarHBondContact O-N 3.02Å; M667-D670 PolarHBondContact O-N 3.23Å; D670-L673 PolarHBondContact O-N 3.09Å; D670-R674 WeakPolarHBondContact O-CG 3.49Å; D670-R674 PolarHBondContact O-N 3Å; D670-R674 IonicContact OD2-CZ 3.77Å; D670-R674 IonicContact OD2-NH1 2.71Å; D670-R674 PolarHBondContact OD2-NH1 2.9Å; D670-R674 IonicContact OD2-NH2 3.97Å
671	D	70.1	Confident	59.4	Low	89 Å²	89	118.6 Å²	118.6	48%	0.476	58%	0.584	S	S	.	*	H	α-helix	trans	-71	-37.1	173.1	-91.5	3.3	0	0	0	112.7	M667 L673 R674 R675	M667-D671 PolarHBondContact O-N 3.07Å; D671-L673 VanDerWaalsContact C-N 3.3Å; D671-L673 PolarHBondContact O-N 3.27Å; D671-R674 PolarHBondContact O-N 3.27Å; D671-R674 IonicContact OD1-CZ 2.62Å; D671-R674 IonicContact OD1-NE 2.91Å; D671-R674 PolarHBondContact OD1-NE 3.48Å; D671-R674 IonicContact OD1-NH2 2.7Å; D671-R674 PolarHBondContact OD1-NH2 3.19Å; D671-R675 WeakPolarHBondContact O-CB 3.42Å; D671-R675 PolarHBondContact O-N 3Å
672	F	73.3	Confident	58.6	Low	141 Å²	141	111.6 Å²	111.6	62%	0.618	58%	0.581	S	S	*	*	H	α-helix	trans	-60.6	-41.2	170.9	-179.3	-97.6	0	0	0	111.3	R668 V669 T676	R668-F672 VanDerWaalsContact O-CB 3.29Å; R668-F672 WeakPolarHBondContact O-CB 3.43Å; R668-F672 PolarHBondContact O-N 3.48Å; V669-F672 PolarHBondContact O-N 2.92Å; F672-T676 HydrophobicContact CE1-CG2 4.23Å; F672-T676 HydrophobicContact CE2-CG2 4.22Å; F672-T676 HydrophobicContact CZ-CG2 4.05Å; F672-T676 WeakPolarHBondContact O-CB 3.33Å; F672-T676 WeakPolarHBondContact O-CG2 3.43Å; F672-T676 PolarHBondContact O-N 3.17Å; F672-T676 PolarHBondContact O-OG1 3.22Å
673	L	77.4	Confident	58	Low	72 Å²	72	118.4 Å²	118.4	38%	0.377	60%	0.598	S	S	.	*	H	α-helix	trans	-67.1	-42.2	174.4	-73.7	168.3	0	0	0	112.3	V669 D670 D671 T676 Q677	V669-L673 HydrophobicContact CG1-CD1 3.96Å; V669-L673 WeakPolarHBondContact O-CB 3.41Å; V669-L673 VanDerWaalsContact O-CG 3.28Å; V669-L673 WeakPolarHBondContact O-CG 3.44Å; V669-L673 PolarHBondContact O-N 3.05Å; D670-L673 PolarHBondContact O-N 3.09Å; D671-L673 VanDerWaalsContact C-N 3.3Å; D671-L673 PolarHBondContact O-N 3.27Å; L673-T676 PolarHBondContact O-OG1 2.7Å; L673-Q677 VanDerWaalsContact O-CB 3.3Å; L673-Q677 WeakPolarHBondContact O-CB 3.33Å; L673-Q677 VanDerWaalsContact O-CG 3.24Å; L673-Q677 WeakPolarHBondContact O-CG 3.27Å; L673-Q677 PolarHBondContact O-N 2.83Å
674	R	68.6	Low	57	Low	122 Å²	122	124 Å²	124	46%	0.46	61%	0.613	S	S	.	*	H	α-helix	trans	-60.4	-48.3	173.8	-78.2	-177.3	-80.3	-88.5	10.6	111.8	D670 D671 T676 A678	D670-R674 WeakPolarHBondContact O-CG 3.49Å; D670-R674 PolarHBondContact O-N 3Å; D670-R674 IonicContact OD2-CZ 3.77Å; D670-R674 IonicContact OD2-NH1 2.71Å; D670-R674 PolarHBondContact OD2-NH1 2.9Å; D670-R674 IonicContact OD2-NH2 3.97Å; D671-R674 PolarHBondContact O-N 3.27Å; D671-R674 IonicContact OD1-CZ 2.62Å; D671-R674 IonicContact OD1-NE 2.91Å; D671-R674 PolarHBondContact OD1-NE 3.48Å; D671-R674 IonicContact OD1-NH2 2.7Å; D671-R674 PolarHBondContact OD1-NH2 3.19Å; R674-T676 VanDerWaalsContact C-N 3.34Å; R674-T676 PolarHBondContact O-N 2.8Å; R674-A678 PolarHBondContact O-N 2.77Å
675	R	62.2	Low	55.7	Low	220 Å²	220	125.3 Å²	125.3	83%	0.83	63%	0.63	S	S	*	*	H	α-helix	trans	-69.6	-29.1	-176.5	-151.7	167.5	-168.4	159.2	1.8	112.7	D671	D671-R675 WeakPolarHBondContact O-CB 3.42Å; D671-R675 PolarHBondContact O-N 3Å
676	T	52.6	Low	54.2	Low	64 Å²	64	128.8 Å²	128.8	39%	0.393	64%	0.641	S	S	.	*	H	α-helix	trans	-85.4	-33.9	175.6	52.4	0	0	0	0	114	F672 L673 R674 A678	F672-T676 HydrophobicContact CE1-CG2 4.23Å; F672-T676 HydrophobicContact CE2-CG2 4.22Å; F672-T676 HydrophobicContact CZ-CG2 4.05Å; F672-T676 WeakPolarHBondContact O-CB 3.33Å; F672-T676 WeakPolarHBondContact O-CG2 3.43Å; F672-T676 PolarHBondContact O-N 3.17Å; F672-T676 PolarHBondContact O-OG1 3.22Å; L673-T676 PolarHBondContact O-OG1 2.7Å; R674-T676 VanDerWaalsContact C-N 3.34Å; R674-T676 PolarHBondContact O-N 2.8Å; T676-A678 VanDerWaalsContact C-N 3.34Å; T676-A678 PolarHBondContact O-N 3.27Å
677	Q	48.3	Very low	53	Low	130 Å²	130	130 Å²	130	61%	0.607	65%	0.654	S	S	*	*	H	α-helix	trans	-71	-27.2	178.4	-73.8	-179.5	24.7	0	0	113.5	L673 V679 V680	L673-Q677 VanDerWaalsContact O-CB 3.3Å; L673-Q677 WeakPolarHBondContact O-CB 3.33Å; L673-Q677 VanDerWaalsContact O-CG 3.24Å; L673-Q677 WeakPolarHBondContact O-CG 3.27Å; L673-Q677 PolarHBondContact O-N 2.83Å; Q677-V679 PolarHBondContact O-N 3.23Å; Q677-V679 VanDerWaalsContact O-N 3.13Å; Q677-V680 PolarHBondContact O-N 3.25Å
678	A	46.4	Very low	51.1	Low	78 Å²	78	136.5 Å²	136.5	65%	0.645	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-23.8	179.9	0	0	0	0	0	114.1	R674 T676 V680	R674-A678 PolarHBondContact O-N 2.77Å; T676-A678 VanDerWaalsContact C-N 3.34Å; T676-A678 PolarHBondContact O-N 3.27Å; A678-V680 VanDerWaalsContact C-N 3.35Å; A678-V680 PolarHBondContact O-N 3.4Å
679	V	46.7	Very low	49	Very low	123 Å²	123	135.3 Å²	135.3	75%	0.745	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-14.6	-172.3	-165.9	0	0	0	0	113.2	Q677	Q677-V679 PolarHBondContact O-N 3.23Å; Q677-V679 VanDerWaalsContact O-N 3.13Å
680	V	39.9	Very low	47.1	Very low	128 Å²	128	141.7 Å²	141.7	78%	0.776	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-16.5	-162.7	-175	0	0	0	0	114.9	Q677 A678	Q677-V680 PolarHBondContact O-N 3.25Å; A678-V680 VanDerWaalsContact C-N 3.35Å; A678-V680 PolarHBondContact O-N 3.4Å
681	S	39.6	Very low	45.2	Very low	107 Å²	107	143 Å²	143	75%	0.748	70%	0.698	S	S	*	*			trans	-117	37.5	-165.5	59.5	0	0	0	0	116.3
682	G	34.6	Very low	43.3	Very low	75 Å²	75	148.5 Å²	148.5	77%	0.773	71%	0.712	S	S	*	*			trans	-94	-2.9	-172.1	0	0	0	0	0	119.5
683	R	36.4	Very low	41.3	Very low	221 Å²	221	150.6 Å²	150.6	83%	0.834	72%	0.724	S	S	*	*			trans	-130.5	90.3	-173.1	-72.2	-167.5	179.7	-140	1.5	115.7
684	R	29.5	Very low	39.2	Very low	256 Å²	256	158.7 Å²	158.7	97%	0.966	75%	0.75	S	S	*	*			trans	-153.7	123.7	146.8	-127.1	177.4	-173.2	-160	2.2	113.6
685	S	34.7	Very low	37.3	Very low	113 Å²	113	162.3 Å²	162.3	79%	0.79	77%	0.772	S	S	*	*			trans	-100.2	157.6	-179.1	54.2	0	0	0	0	112.5
686	R	32.3	Very low	36.1	Very low	249 Å²	249	162.7 Å²	162.7	94%	0.94	77%	0.773	S	S	*	*			trans	-157	161	153.3	-97.9	-153.3	164.6	148.2	-2	111.3
687	P	41.5	Very low	35.5	Very low	112 Å²	112	166.5 Å²	166.5	73%	0.727	79%	0.791	S	S	*	*			trans	-132.5	179.8	-135	43.5	-29.6	0	0	0	115.6
688	R	28.4	Very low	34.8	Very low	250 Å²	250	172 Å²	172	94%	0.943	81%	0.806	S	S	*	*			trans	-149.8	129.2	146.8	-111	164	-172.3	145.1	3.3	111
689	E	30.5	Very low	34.8	Very low	146 Å²	146	174.2 Å²	174.2	68%	0.682	81%	0.814	S	S	*	*			trans	-84.2	165.6	171	-63	-177.5	168.3	0	0	112
690	R	28.4	Very low	34.4	Very low	198 Å²	198	179.2 Å²	179.2	75%	0.747	82%	0.82	S	S	*	*				119.3	152.3	121.5	-157.9	163.2	-74.4	-145.2	-1.5	114.5
691	D	27.5	Very low	34.9	Very low	108 Å²	108	179.2 Å²	179.2	58%	0.578	82%	0.815	S	S	*	*			trans	72.2	127.3	-176.8	-66.9	-24.7	0	0	0	115.4
692	R	30.8	Very low	35	Very low	205 Å²	205	179.2 Å²	179.2	77%	0.774	81%	0.807	S	S	*	*			cis	-146.5	130.9	-2.8	-98	156.5	-170.9	84.4	25.9	109.9
693	E	31	Very low	35.4	Very low	186 Å²	186	185 Å²	185	87%	0.869	81%	0.805	S	S	*	*			trans	-73.7	128.8	151.6	-66.3	-173.5	122.9	0	0	109
694	R	33.6	Very low	35.9	Very low	242 Å²	242	183.9 Å²	183.9	91%	0.913	80%	0.801	S	S	*	*			trans	167.1	95.3	148.9	-93.4	157.5	-163.5	-164.8	5.5	110.4
695	E	28.7	Very low	36.7	Very low	198 Å²	198	176.7 Å²	176.7	93%	0.925	78%	0.781	S	S	*	*				-177.5	123.1	115	-98.9	179.5	-176.6	0	0	109.1
696	R	37.7	Very low	37.3	Very low	228 Å²	228	178.2 Å²	178.2	86%	0.86	77%	0.77	S	S	*	*			trans	-94.9	172.4	169.8	-80.6	-171.2	175.4	-176.3	-0.2	109.7
697	D	39.8	Very low	38	Very low	144 Å²	144	172.5 Å²	172.5	77%	0.77	75%	0.754	S	S	*	*			trans	76.9	90.6	157.5	-51.3	-35.5	0	0	0	118.4
698	R	33.2	Very low	38.5	Very low	246 Å²	246	175.8 Å²	175.8	93%	0.928	75%	0.752	S	S	*	*			trans	-156.7	135.8	130.9	-102.5	148.4	-166.4	179.6	6.6	111
699	P	45.2	Very low	39.5	Very low	124 Å²	124	167.7 Å²	167.7	81%	0.805	73%	0.728	S	S	*	*			trans	-80.9	155.1	-172	32.8	-36.4	0	0	0	113.1
700	R	38.4	Very low	40.6	Very low	228 Å²	228	167.7 Å²	167.7	86%	0.86	72%	0.721	S	S	*	*			trans	-136.2	15	178.6	-137.9	179	-167.9	-176.9	5.8	116.3	N702	R700-N702 PolarHBondContact O-N 2.82Å
701	D	50.9	Low	42.3	Very low	128 Å²	128	160 Å²	160	68%	0.684	70%	0.704	S	S	*	*			trans	-73.4	86.5	173.1	-69.6	-64	0	0	0	111.4
702	N	41.6	Very low	43.9	Very low	106 Å²	106	160.9 Å²	160.9	57%	0.567	70%	0.699	S	S	*	*			trans	-152.3	8.4	174.6	-117.2	-89.8	0	0	0	113.9	R700 R706	R700-N702 PolarHBondContact O-N 2.82Å; N702-R706 PolarHBondContact O-NH1 3.2Å; N702-R706 PolarHBondContact OD1-NH1 3.05Å
703	R	42.6	Very low	45.2	Very low	198 Å²	198	155.5 Å²	155.5	75%	0.747	69%	0.685	S	S	*	*	S	Bend	trans	-104	-45.9	177.5	-80.7	-171.7	171.1	-174	-4	113.8	D705 R706	R703-D705 PolarHBondContact O-N 3.17Å; R703-R706 PolarHBondContact O-N 3.02Å
704	R	48.6	Very low	46.9	Very low	197 Å²	197	154.9 Å²	154.9	74%	0.743	68%	0.675	S	S	*	*	S	Bend	trans	-57.2	-44.4	-171.6	-76.1	179.6	168.5	176.8	-5.5	113.8	R706 E707 R708	R704-R706 PolarHBondContact O-N 3.16Å; R704-E707 PolarHBondContact O-N 2.92Å; R704-E707 VanDerWaalsContact O-N 3.13Å; R704-R708 PolarHBondContact O-N 2.93Å
705	D	45.8	Very low	48.3	Very low	104 Å²	104	149.5 Å²	149.5	56%	0.556	66%	0.66	S	S	*	*	H	α-helix	trans	-68.2	-35.6	-176	-51.9	-58.4	0	0	0	112.8	R703 E707 R708 D709	R703-D705 PolarHBondContact O-N 3.17Å; D705-E707 PolarHBondContact O-N 2.68Å; D705-E707 VanDerWaalsContact O-N 3.12Å; D705-R708 PolarHBondContact O-N 3.46Å; D705-D709 PolarHBondContact O-N 2.91Å
706	R	47.6	Very low	50.2	Low	145 Å²	145	145.9 Å²	145.9	55%	0.547	64%	0.638	S	S	.	*	H	α-helix	trans	-65.8	-11.9	175.2	-71.7	-174.9	171.3	95.6	-1.1	113.7	N702 R703 R704 R710	N702-R706 PolarHBondContact O-NH1 3.2Å; N702-R706 PolarHBondContact OD1-NH1 3.05Å; R703-R706 PolarHBondContact O-N 3.02Å; R704-R706 PolarHBondContact O-N 3.16Å; R706-R710 WeakPolarHBondContact O-CD 3.3Å; R706-R710 WeakPolarHBondContact O-CG 3.49Å; R706-R710 PolarHBondContact O-NH1 2.91Å
707	E	46.7	Very low	51.6	Low	130 Å²	130	140.8 Å²	140.8	61%	0.607	62%	0.624	S	S	*	*	H	α-helix	trans	-95.9	-35.4	174.5	-71.7	167.5	-178.2	0	0	111	R704 D705 R710 G711	R704-E707 PolarHBondContact O-N 2.92Å; R704-E707 VanDerWaalsContact O-N 3.13Å; D705-E707 PolarHBondContact O-N 2.68Å; D705-E707 VanDerWaalsContact O-N 3.12Å; E707-R710 PolarHBondContact O-N 3.31Å; E707-G711 PolarHBondContact O-N 2.83Å
708	R	51.7	Low	53	Low	180 Å²	180	143.2 Å²	143.2	68%	0.679	62%	0.623	S	S	*	*	H	α-helix	trans	-59.8	-47.7	176.1	-112.6	177.4	179.2	172.3	-0	113.2	R704 D705 R710 G711 R712	R704-R708 PolarHBondContact O-N 2.93Å; D705-R708 PolarHBondContact O-N 3.46Å; R708-R710 PolarHBondContact O-N 3.08Å; R708-G711 PolarHBondContact O-N 3.25Å; R708-R712 PolarHBondContact O-N 3.2Å
709	D	49.2	Very low	54.8	Low	81 Å²	81	137.2 Å²	137.2	43%	0.433	61%	0.605	S	S	.	*	H	α-helix	trans	-71.1	-31.7	-177.8	-68.9	-31.4	0	0	0	112.7	D705 G711 R712 D713	D705-D709 PolarHBondContact O-N 2.91Å; D709-G711 PolarHBondContact O-N 3.41Å; D709-R712 PolarHBondContact O-N 3.49Å; D709-R712 IonicContact OD1-CZ 3.94Å; D709-R712 IonicContact OD1-NH1 3.52Å; D709-R712 PolarHBondContact OD1-NH1 2.88Å; D709-D713 PolarHBondContact O-N 3.17Å; D709-D713 VanDerWaalsContact O-N 3.14Å
710	R	54.3	Low	56.1	Low	145 Å²	145	139 Å²	139	55%	0.547	60%	0.596	S	S	.	*	H	α-helix	trans	-68.2	-17.8	172.6	-69	-175.5	-177.1	121.1	-15.9	113.8	R706 E707 R708 R714	R706-R710 WeakPolarHBondContact O-CD 3.3Å; R706-R710 WeakPolarHBondContact O-CG 3.49Å; R706-R710 PolarHBondContact O-NH1 2.91Å; E707-R710 PolarHBondContact O-N 3.31Å; R708-R710 PolarHBondContact O-N 3.08Å; R710-R714 VanDerWaalsContact O-CD 3.3Å; R710-R714 WeakPolarHBondContact O-CD 3.26Å; R710-R714 WeakPolarHBondContact O-CG 3.43Å
711	G	62.5	Low	57.6	Low	37 Å²	37	132.6 Å²	132.6	38%	0.381	58%	0.578	S	S	.	*	H	α-helix	trans	-70.9	-57.9	167.4	0	0	0	0	0	110.9	E707 R708 D709 D713 R714 E715	E707-G711 PolarHBondContact O-N 2.83Å; R708-G711 PolarHBondContact O-N 3.25Å; D709-G711 PolarHBondContact O-N 3.41Å; G711-D713 VanDerWaalsContact C-N 3.32Å; G711-D713 PolarHBondContact O-N 2.83Å; G711-R714 PolarHBondContact O-N 3.17Å; G711-R714 VanDerWaalsContact O-N 3.12Å; G711-E715 PolarHBondContact O-N 3.48Å
712	R	61.3	Low	58.5	Low	127 Å²	127	130.6 Å²	130.6	48%	0.479	57%	0.573	S	S	.	*	H	α-helix	trans	-55.3	-40.6	-176.5	-66.4	170.2	172.6	156.7	-9.3	113.7	R708 D709 E715 R716	R708-R712 PolarHBondContact O-N 3.2Å; D709-R712 PolarHBondContact O-N 3.49Å; D709-R712 IonicContact OD1-CZ 3.94Å; D709-R712 IonicContact OD1-NH1 3.52Å; D709-R712 PolarHBondContact OD1-NH1 2.88Å; R712-E715 PolarHBondContact O-N 2.73Å; R712-R716 WeakPolarHBondContact O-CD 3.4Å; R712-R716 VanDerWaalsContact O-CG 3.3Å; R712-R716 WeakPolarHBondContact O-CG 3.25Å; R712-R716 PolarHBondContact O-N 3.4Å
713	D	59.8	Low	59.8	Low	91 Å²	91	129.6 Å²	129.6	49%	0.487	57%	0.568	S	S	.	*	H	α-helix	trans	-73.1	-28.7	-178.4	-74.6	-21.6	0	0	0	113.2	D709 G711 R716 E717	D709-D713 PolarHBondContact O-N 3.17Å; D709-D713 VanDerWaalsContact O-N 3.14Å; G711-D713 VanDerWaalsContact C-N 3.32Å; G711-D713 PolarHBondContact O-N 2.83Å; D713-R716 IonicContact OD1-CZ 3.94Å; D713-R716 IonicContact OD1-NH1 2.69Å; D713-R716 PolarHBondContact OD1-NH1 3.12Å; D713-E717 WeakPolarHBondContact O-CB 3.22Å; D713-E717 PolarHBondContact O-N 2.83Å; D713-E717 VanDerWaalsContact O-N 3.07Å
714	R	65.7	Low	60.9	Low	173 Å²	173	127.7 Å²	127.7	65%	0.653	56%	0.561	S	S	*	*	H	α-helix	trans	-71.5	-34.1	171.8	-69.7	171.3	175.4	155.7	-5.7	112.3	R710 G711 E717 R718	R710-R714 VanDerWaalsContact O-CD 3.3Å; R710-R714 WeakPolarHBondContact O-CD 3.26Å; R710-R714 WeakPolarHBondContact O-CG 3.43Å; G711-R714 PolarHBondContact O-N 3.17Å; G711-R714 VanDerWaalsContact O-N 3.12Å; R714-E717 PolarHBondContact O-N 3.19Å; R714-R718 PolarHBondContact O-N 3.42Å; R714-R718 VanDerWaalsContact O-N 3.09Å
715	E	63.2	Low	61.6	Low	130 Å²	130	122.2 Å²	122.2	61%	0.607	55%	0.546	S	S	*	.	H	α-helix	trans	-66.6	-50.9	176.4	-172.2	164.7	-128.5	0	0	110.8	G711 R712 E717 R718 E719	G711-E715 PolarHBondContact O-N 3.48Å; R712-E715 PolarHBondContact O-N 2.73Å; E715-E717 PolarHBondContact O-N 3.16Å; E715-R718 WeakPolarHBondContact O-CB 3.38Å; E715-R718 PolarHBondContact O-N 2.96Å; E715-E719 PolarHBondContact O-N 3.22Å; E715-E719 VanDerWaalsContact O-N 3.1Å
716	R	68.9	Low	62.5	Low	122 Å²	122	125.3 Å²	125.3	46%	0.46	55%	0.55	S	S	.	.	H	α-helix	trans	-55.7	-33.4	170.4	-69.8	163.4	171.6	170	-4.3	113.3	R712 D713 R720	R712-R716 WeakPolarHBondContact O-CD 3.4Å; R712-R716 VanDerWaalsContact O-CG 3.3Å; R712-R716 WeakPolarHBondContact O-CG 3.25Å; R712-R716 PolarHBondContact O-N 3.4Å; D713-R716 IonicContact OD1-CZ 3.94Å; D713-R716 IonicContact OD1-NH1 2.69Å; D713-R716 PolarHBondContact OD1-NH1 3.12Å; R716-R720 WeakPolarHBondContact O-CB 3.46Å; R716-R720 VanDerWaalsContact O-CD 3.3Å; R716-R720 WeakPolarHBondContact O-CD 3.17Å; R716-R720 WeakPolarHBondContact O-CG 3.19Å; R716-R720 PolarHBondContact O-N 2.89Å
717	E	66	Low	62.9	Low	121 Å²	121	122 Å²	122	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-72.5	-34.2	177.3	-163.2	163.8	-126.2	0	0	112.1	D713 R714 E715 L721	D713-E717 WeakPolarHBondContact O-CB 3.22Å; D713-E717 PolarHBondContact O-N 2.83Å; D713-E717 VanDerWaalsContact O-N 3.07Å; R714-E717 PolarHBondContact O-N 3.19Å; E715-E717 PolarHBondContact O-N 3.16Å; E717-L721 WeakPolarHBondContact O-CD1 3.5Å; E717-L721 PolarHBondContact O-N 3.13Å
718	R	70.6	Confident	63.5	Low	195 Å²	195	123.7 Å²	123.7	74%	0.736	54%	0.544	S	S	*	.	H	α-helix	trans	-64.8	-46.6	170.6	-74.3	-174.3	172.5	-159.7	-1	112.4	R714 E715 R720 L721 C722	R714-R718 PolarHBondContact O-N 3.42Å; R714-R718 VanDerWaalsContact O-N 3.09Å; E715-R718 WeakPolarHBondContact O-CB 3.38Å; E715-R718 PolarHBondContact O-N 2.96Å; R718-R720 VanDerWaalsContact C-N 3.32Å; R718-R720 PolarHBondContact O-N 2.88Å; R718-L721 WeakPolarHBondContact O-CB 3.35Å; R718-L721 PolarHBondContact O-N 3.02Å; R718-C722 PolarHBondContact O-N 3.13Å
719	E	69.8	Low	63.6	Low	119 Å²	119	117.2 Å²	117.2	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-55.6	-47.8	176.8	-66.1	-178.2	125.2	0	0	111.4	E715 L721 C722 D723	E715-E719 PolarHBondContact O-N 3.22Å; E715-E719 VanDerWaalsContact O-N 3.1Å; E719-L721 PolarHBondContact O-N 3.33Å; E719-L721 VanDerWaalsContact O-N 3.13Å; E719-C722 PolarHBondContact O-N 3.09Å; E719-C722 VanDerWaalsContact O-N 3.1Å; E719-D723 PolarHBondContact O-N 2.77Å
720	R	72.9	Confident	63.8	Low	161 Å²	161	119.7 Å²	119.7	61%	0.608	54%	0.542	S	S	*	.	H	α-helix	trans	-63.3	-15.7	177	-71	167.7	-179.2	176.3	0.6	115	R716 R718 R724	R716-R720 WeakPolarHBondContact O-CB 3.46Å; R716-R720 VanDerWaalsContact O-CD 3.3Å; R716-R720 WeakPolarHBondContact O-CD 3.17Å; R716-R720 WeakPolarHBondContact O-CG 3.19Å; R716-R720 PolarHBondContact O-N 2.89Å; R718-R720 VanDerWaalsContact C-N 3.32Å; R718-R720 PolarHBondContact O-N 2.88Å; R720-R724 WeakPolarHBondContact O-CB 3.41Å
721	L	70.4	Confident	63.7	Low	94 Å²	94	121.6 Å²	121.6	49%	0.492	55%	0.55	S	S	.	.	H	α-helix	trans	-87.7	-47.6	169.8	-99.8	124.9	0	0	0	110.7	E717 R718 E719 D723 R724 D725	E717-L721 WeakPolarHBondContact O-CD1 3.5Å; E717-L721 PolarHBondContact O-N 3.13Å; R718-L721 WeakPolarHBondContact O-CB 3.35Å; R718-L721 PolarHBondContact O-N 3.02Å; E719-L721 PolarHBondContact O-N 3.33Å; E719-L721 VanDerWaalsContact O-N 3.13Å; L721-D723 PolarHBondContact O-N 3.04Å; L721-R724 WeakPolarHBondContact O-CB 3.36Å; L721-R724 PolarHBondContact O-N 3.34Å; L721-R724 VanDerWaalsContact O-N 3.07Å; L721-D725 PolarHBondContact O-N 2.87Å
722	C	70.6	Confident	63.2	Low	86 Å²	86	122.7 Å²	122.7	58%	0.581	56%	0.56	S	S	*	*	H	α-helix	trans	-57.7	-44.2	177.7	-68.2	0	0	0	0	112.8	R718 E719 R724 D725 R726	R718-C722 PolarHBondContact O-N 3.13Å; E719-C722 PolarHBondContact O-N 3.09Å; E719-C722 VanDerWaalsContact O-N 3.1Å; C722-R724 VanDerWaalsContact C-N 3.31Å; C722-R724 PolarHBondContact O-N 2.96Å; C722-D725 PolarHBondContact O-N 2.95Å; C722-R726 WeakPolarHBondContact O-CB 3.15Å; C722-R726 PolarHBondContact O-N 3.21Å
723	D	67.6	Low	62.7	Low	86 Å²	86	127.1 Å²	127.1	46%	0.46	58%	0.577	S	S	.	*	H	α-helix	trans	-67.6	-31.3	175.9	-78	-33.5	0	0	0	112.9	E719 L721 R726 D727	E719-D723 PolarHBondContact O-N 2.77Å; L721-D723 PolarHBondContact O-N 3.04Å; D723-R726 WeakPolarHBondContact O-CB 3.31Å; D723-R726 PolarHBondContact O-N 3.1Å; D723-R726 IonicContact OD1-CZ 2.82Å; D723-R726 IonicContact OD1-NH1 3.9Å; D723-R726 PolarHBondContact OD1-NH1 3.25Å; D723-D727 WeakPolarHBondContact O-CB 3.4Å; D723-D727 PolarHBondContact O-N 2.99Å
724	R	65.7	Low	62.2	Low	158 Å²	158	133.1 Å²	133.1	60%	0.596	59%	0.594	S	S	*	*	H	α-helix	trans	-70.1	-35.6	178.4	-168.6	178.9	-55.1	177.1	6.1	112.3	R720 L721 C722 R728	R720-R724 WeakPolarHBondContact O-CB 3.41Å; L721-R724 WeakPolarHBondContact O-CB 3.36Å; L721-R724 PolarHBondContact O-N 3.34Å; L721-R724 VanDerWaalsContact O-N 3.07Å; C722-R724 VanDerWaalsContact C-N 3.31Å; C722-R724 PolarHBondContact O-N 2.96Å; R724-R728 VanDerWaalsContact O-CB 3.29Å; R724-R728 WeakPolarHBondContact O-CB 3.47Å; R724-R728 PolarHBondContact O-N 3Å; R724-R728 VanDerWaalsContact O-N 3.08Å
725	D	63.2	Low	61.5	Low	82 Å²	82	135.9 Å²	135.9	44%	0.439	61%	0.605	S	S	.	*	H	α-helix	trans	-79.5	-28.1	174.3	-74.9	-39.6	0	0	0	112.5	L721 C722 R728 G729	L721-D725 PolarHBondContact O-N 2.87Å; C722-D725 PolarHBondContact O-N 2.95Å; D725-R728 IonicContact OD1-CZ 2.78Å; D725-R728 IonicContact OD1-NH1 3.07Å; D725-R728 PolarHBondContact OD1-NH1 2.83Å; D725-G729 PolarHBondContact O-N 2.66Å
726	R	64.3	Low	60.5	Low	168 Å²	168	145 Å²	145	63%	0.634	63%	0.634	S	S	*	*	H	α-helix	trans	-60.7	-52	166.5	-177.5	-178.1	-78.3	149.5	-12	111.4	C722 D723 R728 G729 E730	C722-R726 WeakPolarHBondContact O-CB 3.15Å; C722-R726 PolarHBondContact O-N 3.21Å; D723-R726 WeakPolarHBondContact O-CB 3.31Å; D723-R726 PolarHBondContact O-N 3.1Å; D723-R726 IonicContact OD1-CZ 2.82Å; D723-R726 IonicContact OD1-NH1 3.9Å; D723-R726 PolarHBondContact OD1-NH1 3.25Å; R726-R728 VanDerWaalsContact C-N 3.31Å; R726-R728 PolarHBondContact O-N 3.45Å; R726-G729 WeakPolarHBondContact O-CA 3.39Å; R726-G729 PolarHBondContact O-N 2.71Å; R726-E730 PolarHBondContact O-N 2.65Å
727	D	57.3	Low	60.1	Low	75 Å²	75	146.2 Å²	146.2	40%	0.401	64%	0.643	S	S	.	*	H	α-helix	trans	-63.6	-34.2	178.7	-164.9	78.5	0	0	0	112.5	D723 G729 R731	D723-D727 WeakPolarHBondContact O-CB 3.4Å; D723-D727 PolarHBondContact O-N 2.99Å; D727-G729 VanDerWaalsContact C-N 3.35Å; D727-R731 WeakPolarHBondContact O-CG 3.44Å; D727-R731 PolarHBondContact O-N 2.98Å; D727-R731 IonicContact OD1-NH2 2.74Å; D727-R731 IonicContact OD2-CZ 3.81Å; D727-R731 IonicContact OD2-NE 3.2Å; D727-R731 PolarHBondContact OD2-NE 3.31Å; D727-R731 IonicContact OD2-NH2 2.69Å; D727-R731 PolarHBondContact OD2-NH2 3.4Å
728	R	58.5	Low	59.8	Low	166 Å²	166	147.5 Å²	147.5	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-67	-33.2	171.7	-178.6	-179.7	-80.5	156.1	-13.4	112.5	R724 D725 R726	R724-R728 VanDerWaalsContact O-CB 3.29Å; R724-R728 WeakPolarHBondContact O-CB 3.47Å; R724-R728 PolarHBondContact O-N 3Å; R724-R728 VanDerWaalsContact O-N 3.08Å; D725-R728 IonicContact OD1-CZ 2.78Å; D725-R728 IonicContact OD1-NH1 3.07Å; D725-R728 PolarHBondContact OD1-NH1 2.83Å; R726-R728 VanDerWaalsContact C-N 3.31Å; R726-R728 PolarHBondContact O-N 3.45Å
729	G	54.5	Low	59.2	Low	44 Å²	44	144.9 Å²	144.9	45%	0.454	64%	0.642	S	S	.	*	H	α-helix	trans	-68	-39.6	177	0	0	0	0	0	113.8	D725 R726 D727 G732	D725-G729 PolarHBondContact O-N 2.66Å; R726-G729 WeakPolarHBondContact O-CA 3.39Å; R726-G729 PolarHBondContact O-N 2.71Å; D727-G729 VanDerWaalsContact C-N 3.35Å; G729-G732 PolarHBondContact O-N 3.42Å
730	E	52.3	Low	58.6	Low	134 Å²	134	146.4 Å²	146.4	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-72.3	-41.5	-179.4	-64	-156.8	140.7	0	0	112.7	R726 G732 R733	R726-E730 PolarHBondContact O-N 2.65Å; E730-G732 PolarHBondContact O-N 3.2Å; E730-R733 PolarHBondContact O-N 3.22Å
731	R	53	Low	57.7	Low	185 Å²	185	145.5 Å²	145.5	70%	0.698	65%	0.649	S	S	*	*	H	α-helix	trans	-60.3	-19.1	176.7	-65	178.8	-161.7	-129.3	3	113.3	D727	D727-R731 WeakPolarHBondContact O-CG 3.44Å; D727-R731 PolarHBondContact O-N 2.98Å; D727-R731 IonicContact OD1-NH2 2.74Å; D727-R731 IonicContact OD2-CZ 3.81Å; D727-R731 IonicContact OD2-NE 3.2Å; D727-R731 PolarHBondContact OD2-NE 3.31Å; D727-R731 IonicContact OD2-NH2 2.69Å; D727-R731 PolarHBondContact OD2-NH2 3.4Å
732	G	50.9	Low	56.8	Low	59 Å²	59	148.9 Å²	148.9	61%	0.608	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-19.1	173.7	0	0	0	0	0	115.1	G729 E730	G729-G732 PolarHBondContact O-N 3.42Å; E730-G732 PolarHBondContact O-N 3.2Å
733	R	51.9	Low	55.8	Low	220 Å²	220	153.4 Å²	153.4	83%	0.83	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-9.6	-172.1	-65	-167.8	179.4	-146.9	1.8	115.5	E730	E730-R733 PolarHBondContact O-N 3.22Å
734	Y	49.2	Very low	54.9	Low	217 Å²	217	158.6 Å²	158.6	85%	0.851	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	21.6	-178.8	-76.1	-80.3	0	0	0	114.4
735	R	51.7	Low	54	Low	232 Å²	232	158.7 Å²	158.7	88%	0.875	69%	0.688	S	S	*	*			trans	-139.2	70.1	172	-77.2	-167.6	171.6	-171.7	-2.1	112.9
736	R	41.5	Very low	53.2	Low	322 Å²	322	165.6 Å²	165.6	100%	1.215	71%	0.711	S	S	*	*			trans	-153.5	0	151.9	-131.8	178.8	-171.2	-156	0.2	111.8

Retrieved 736 of 736 residues in 382.2 ms (Link to these results)

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